CAS 7647-15-6 · NaBr · MolGod PREDICTED 3D molecular model (computed by MolGod Scientific, not verified)
Sodium Bromide (CAS 7647-15-6) — MolGod molecule record: properties, safety, literature and sources for this substance.
No source 3-D conformer was available to MolGod for this substance. MolGod Scientific computed this geometry from the structural formula with RDKit 2026.03.6 (no conformer embedding or force-field optimisation was needed: the substance consists of single-atom ions only, whose arrangement is a presentation convention). It is not a measured structure, it does not come from PubChem, and it has not been compared with experimental data. It shows one possible conformation.
This substance consists of 2 separate components (for example ions). Each component was computed separately; they are arranged radially around a layout anchor for visualisation only (at least 3.0 Å apart). Their relative positions are not a crystal structure, coordination geometry, ionic contacts or any experimentally determined arrangement.
undetermined.
A Creative Commons license may only be applied by a party holding the necessary
rights, so this record documents provenance but does not yet grant a license.| Model identifier | MG-STL-7647-15-6
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| CAS Registry Number | 7647-15-6 |
| Name source | cache cas-*.json field "title" (angielski) |
| Molecular formula | NaBr |
| PubChem CID | 253881 |
| InChIKey | JHJLBTNAGRQEKS-UHFFFAOYSA-M |
| Wikidata | Q15768 |
| MolGod molecule record | Sodium Bromide (CAS 7647-15-6) — molecule record |
| Source | PubChem (source record type not recorded for this substance) |
|---|---|
| Endpoint | Not recorded in the MolGod cache entry for this substance. |
| Dimensionality | 2d |
| Retrieved | 2026-09-09 01:12:15 |
| Atoms / bonds | 2 / 1 |
| Modification | PREDICTED geometry. Atomic coordinates were computed by MolGod Scientific (RDKit ETKDGv3 + force field) from the structural formula, because no source 3-D conformer was available. They are not measured, not from PubChem and not verified. |
| 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. |
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| Print scale | Recommended print scale: FDM (0.4 mm nozzle, 0.2 mm layer) at least 3.4 mm per Å (model about 15 mm across); resin printer (50 µm) at least 0.5 mm per Å (about 3 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 | molgod-7647-15-6.stl (31 KB) |
| SHA-256 | fa7505aed2077d9d2949c81f255be9f305358c422f8dfe982488abb1be48c289 |
| MD5 | 8e4ae8723094a60657459ce65af8fedc |
| Size | 32,084 bytes |
| Triangles | 640 |
| Mesh | 2 atom spheres + 1 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; Table XIV, p. 449. Used in this model: Br 1.85 ņ, Na 2.27 Ň. †Br: 1.85 Å as printed in the original (Bondi 1964, Table I, p. 443); later compilations quote Mantina 2009 Table 12 (doi:10.1021/jp8111556): 1.83 Å; Alvarez 2013 Table 1 (doi:10.1039/c3dt50599e): 1.83 Å. We use the value printed in the original. ‡Na: Bondi’s radius of the metal atom in the non-bonded state, derived from critical volumes. For a cation in a salt this is a presentation size, not an ionic radius. 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 (2026-10-15); external cross-check (trimesh/numpy-stl) NOT PERFORMED for this model |
| Generated | 2026-10-15T00:20:07Z |
| License | CC BY-SA 4.0 International |
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| Creator | MolGod Scientific |
| Required attribution | "Sodium Bromide (CAS 7647-15-6) — PREDICTED 3D molecular model (computed by MolGod Scientific, not verified)" by MolGod Scientific. PREDICTED geometry: conformer computed by MolGod Scientific with RDKit (ETKDGv3) from the PubChem structural formula, NOT verified against measured data; rendered as a triangulated mesh (van der Waals spheres and bond cylinders). LICENCE NOT YET GRANTED: source rights are not established, so no Creative Commons licence is asserted for this model. Provenance: https://molgod.org/licenses/stl/7647-15-6/ |
| Wikimedia Commons tag | {{Cc-by-sa-4.0}} |
| Source representation | PubChem record used for identity and connectivity only (SMILES, InChIKey). no source 3D conformer was available to MolGod for this substance; the geometry is a PREDICTED conformer computed by MolGod Scientific and is not verified. |
| 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 | undetermined — 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 253881 |
| 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/7647-15-6/ |
| License & provenance URL | https://molgod.org/licenses/stl/7647-15-6/ |
| 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 MG-STL-7647-15-6
(SHA-256 fa7505aed2077d9d2949c81f255be9f305358c422f8dfe982488abb1be48c289),
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.