CAS 58-08-2 · C8H10N4O2 · MolGod 3D molecular model
caffeine (CAS 58-08-2) — full MolGod record: all data sections for this substance — properties, safety, regulatory status, spectra, literature.
| MolGod Identification Number | MG_751-125-824-41
|
|---|---|
| CAS Registry Number | 58-08-2 |
| Name source | MolGod_Name_Registry (en) |
| Molecular formula | C8H10N4O2 |
| PubChem CID | 2519 |
| InChIKey | RYYVLZVUVIJVGH-UHFFFAOYSA-N |
| Wikidata | Q60235 |
| MolGod molecule record | caffeine (CAS 58-08-2) — molecule record |
| Full MolGod record | caffeine — full record (all data sections) |
| Source | PubChem, record_type=3d (computed conformer) |
|---|---|
| Endpoint | https://pubchem.ncbi.nlm.nih.gov/rest/pug/compound/cid/2519/record/SDF?record_type=3d |
| Dimensionality | 3d |
| Retrieved | 2026-10-08 01:27:22 |
| Atoms / bonds | 24 / 25 |
| Modification | None. Atomic coordinates and connectivity are used unchanged; no geometry was modelled, adjusted or inferred. |
Download image
Rendered from this exact STL file, not from a second source.
Single material — the STL format carries no colour channel. Colours in the preview are assigned by the renderer from the element palette and are not part of the downloadable geometry.
Download image
The element symbol is cut into the sphere, not printed on it. That single difference is what this variant is for.
Why the preview looks the way it does. A carved letter has no colour of its own — on a pale atom it would disappear into the highlight. The preview is rendered from the mesh itself with ray-traced cavity shading, so recesses darken because they are recessed, not because we painted them. What you see is the geometry you will receive. The element colours follow the same palette as the interactive viewer on this site, so the model and the viewer never disagree about what an atom is.
Element symbols are recessed into the atom spheres. Mesh: 305,524 triangles versus 10,464.
Download engraved variant:
Caffeine-3D-molecular-model-engraved-CAS-58-08-2.stl (15 MB)
SHA-256 3eca6dd62995ddf8377246dabe503be2e5bd4dedd496736a552f04a8749bd3ae
Validation: mesh validity check PASS before publication (2026-10-14); external cross-check NOT PERFORMED for this model
Recommended print scale: FDM (0.4 mm nozzle, 0.2 mm layer) at least 7.2 mm per Å (model about 49 mm across); resin printer (50 µm) at least 1.7 mm per Å (about 12 mm). Below this scale the engraved symbols become too fine to print. The printer limits are typical values assumed by MolGod, not a test of your printer.
The engraved model on a display base, in one file. The molecule is the engraved variant above, unchanged: only scaled, rotated and positioned as a whole.
Download ready-to-print variant: molgod_caffeine_58-08-2_R3-ready-to-print_g2026-10-28_NO-SUPPORTS_add-supports-in-slicer.stl (21 MB, 450,102 triangles, millimetres) · STL · base Ø 100 mm · single integrated solid
| File | molgod_caffeine_58-08-2_R3-ready-to-print_g2026-10-28_NO-SUPPORTS_add-supports-in-slicer.stl · ANT HOUSE v7 SHA-256 61bbb8ec736087dbfad3fb423807465294afff81c257254bf4b07e0728b97f0bSliced on 2026-10-28 (UTC) for this SHA-256 |
|---|---|
| Readiness level | Level 3 of 5 — Slicer Verified (1 Generated · 2 Geometry Validated · 3 Slicer Verified · 4 Physically Printed · 5 Print Qualified). Designed for FDM printing. Geometry validated and slicing checked using the specified profile. No physical print has been made yet. |
| Method | FDM, PLA 1.75 mm |
| Nozzle | 0.4 mm (minimum detail sizes are designed for this nozzle; do not use a larger one) |
| Layer height | 0.2 mm |
| Infill | 15%, 3 perimeters |
| Supports | Yes. 11 pencil supports (Ø 3.5 / 5 mm hexagonal, graphite neck Ø 1.8 mm with a 45° cup under the atom, 10.0–41.3 mm long) are part of the model — do not remove them. Also enable your slicer’s automatic supports: they are temporary (about 25.2 % of the printed volume in our run) — remove them carefully near the smallest spheres (e.g. hydrogen) and thin bonds. In your own slicer: organic (tree) supports with “on build plate only” switched OFF — every tree starts on the base (Cura: Support Placement = Everywhere). After choosing your printer, press A (Arrange) so the model sits in the middle of the bed. |
| Temperature | 3MF profile: 215 °C nozzle on the first layer, then 210 °C; bed 60 °C (starting point — follow your filament manufacturer’s range); part fan on from layer 4. Ready G-code use the printer makers’ own temperatures and fan settings (listed in gcode/README_GCODE.txt in the package). Ready G-code (Prusa MK4, Prusa MINI, Creality Ender-3 S1): 210 °C nozzle on the first layer, then 205 °C; bed 60 °C — values from the header of each file. |
| Orientation | Print as supplied: base flat on the bed (QR code side down); do not rotate |
| Scale | Import at 100 % — the file is in millimetres; do not rescale (molecule scale 1 Å = 10.60 mm) |
| Overall size | 100.0 × 100.0 × 84.1 mm (X × Y × Z); base Ø 100 × 20 mm |
| Validated | 2026-10-28 (UTC): geometry checks on this file |
| Minimum bed | 125 × 125 mm; height 90 mm |
| Estimated print time | about 9 h 52 min (3MF profile in PrusaSlicer; ready G-code times above) |
| Filament (PLA) | about 85–87 g (slicer estimate) |
Preview of the 3D-print model — rotate it with your mouse or finger; switch: with supports / without supports
Drag to rotate; scroll or pinch to zoom.
How this model prints
Renders (PNG):
For print shops:
Technical data sheet (PDF: drawing, dimensions, print specification) · 588 KB · SHA-256 4161deaafa039710…
Print package (ZIP: STL, 3MF with settings, G-code, step-by-step instructions, design notes with sources, what-to-remove picture, previews, slicer profile, gates report, QC checklist, feedback form, licence) · 55 MB · SHA-256 8ad0b62d8de8af97…
61bbb8ec736087dbfad3fb423807465294afff81c257254bf4b07e0728b97f0b
MG_751-125-824-41, variant ready-to-print (STL, millimetres, SHA-256 61bbb8ec736087dbfad3fb423807465294afff81c257254bf4b07e0728b97f0b), licenses this file and the 3MF project and G-code files made from it under CC BY-NC-SA 4.0 International. The licence grant further down this page covers the normal variant only.| Format | STL (binary). Coordinate convention: ångström (Å) — STL itself stores no unit metadata. Slicers read STL as millimetres by default, so set the scale deliberately before printing. |
|---|---|
| Print scale | Recommended print scale: FDM (0.4 mm nozzle, 0.2 mm layer) at least 3.4 mm per Å (model about 28 mm across); resin printer (50 µm) at least 0.5 mm per Å (about 5 mm). Below this scale the thinnest bond cylinders become too thin to print. The printer limits are typical values assumed by MolGod, not a test of your printer. |
| Download | Caffeine-3D-molecular-model-CAS-58-08-2.stl (511 KB) |
| SHA-256 | 9aa8d8a1e01adc890f457a9e603129e4da7b8b6296b3a63040914176e7c77ac6 |
| MD5 | 806b0455f4bf87a83a4115f9f8729ed4 |
| Size | 523,284 bytes |
| Triangles | 10,464 |
| Mesh | 24 atom spheres + 29 bond cylinders (one, two or three per bond, by bond order), each a closed outward-oriented solid; the solids intersect by design. |
| Atomic radii | van der Waals radii from the versioned MolGod table MG2, values from Bondi 1964 (doi:10.1021/j100785a001), checked against the original publication: Table I, p. 443. Used in this model: C 1.70 Å, H 1.20 Å, N 1.55 Å, O 1.52 Å. The file header declares vdw:MG2.Sphere scale and bond radius are presentation parameters, not chemical quantities. |
| Exporter | MolGod STL Exporter build 48804cd20b0d |
| Validator | mesh validity check PASS before publication (2026-10-14); independently confirmed by trimesh 5.1.0 and numpy-stl (10080 triangles, watertight, consistent winding, positive volume), checked 2026-09-26T00:14:31Z |
| Generated | 2026-10-14T18:08:35Z |
| License | CC BY-SA 4.0 International |
|---|---|
| Creator | MolGod Scientific |
| Required attribution | "caffeine (CAS 58-08-2) — 3D molecular model" by MolGod Scientific, licensed under CC BY-SA 4.0 International. Rendered as a triangulated mesh (van der Waals spheres and bond cylinders) from the PubChem-computed 3D conformer; atomic coordinates and connectivity unchanged. Source: https://molgod.org/licenses/stl/58-08-2/ |
| Wikimedia Commons tag | {{Cc-by-sa-4.0}} |
| Source representation | PubChem computed 3D conformer (record_type=3d) — generated by PubChem itself, not supplied by a depositor. |
| Source rights basis | NCBI Molecular Data Usage Policy. NCBI does not itself restrict use or redistribution of molecular data, but does not transfer rights that individual depositors may hold. |
| Rights assessment | compatible — MolGod's own determination that this computed conformer may serve as the geometric basis of a derived mesh. This is not a licence grant by the source. The measured basis is that the conformer is computed by PubChem rather than deposited by a third party. A formal legal assessment of downstream rights has not been carried out; that risk is accepted explicitly and recorded in the MolGod decision register (2026-09-25). |
| Assessment scope | This assessment covers only the computed 3D conformer used as geometric input. It does not extend to depositor data obtained from PubChem — names, spectra, physicochemical values or anything else. |
| Source URL | PubChem CID 2519 |
| Source license terms | NCBI Policies and Disclaimers |
| Source licensing guidance | PubChem data downloads & licensing — PubChem states that an individual data source may provide its own licence terms and that these should be checked per source. This model uses a PubChem-computed conformer, not depositor-supplied data. |
| Attribution URL | https://molgod.org/molecule/58-08-2/ |
| License & provenance URL | https://molgod.org/licenses/stl/58-08-2/ |
| Scope | This license applies to the MolGod-created STL mesh, not automatically to third-party source material. |
| Licence terms & attribution | MolGod licence and attribution rules → |
Licence grant. MolGod Scientific, the creator and
copyright holder of the STL mesh of MolGod entity
MG_751-125-824-41, variant normal
(SHA-256 9aa8d8a1e01adc890f457a9e603129e4da7b8b6296b3a63040914176e7c77ac6),
hereby releases it under the CC BY-SA 4.0 International licence. The release covers the MolGod-created
mesh only, not third-party source material (see Scope above).
The license above is the legal instrument and is granted by its official Creative Commons deed. This page is the MolGod provenance record for the artefact; it documents the source and the pipeline, and does not impose any condition beyond those of the license itself.