CID 174907176

H2BCaMoZn — CID 174907176

IUPAC—
SMILES[B].[Ca+2].[H-].[H-].[Mo].[Zn]
InChIInChI=1S/B.Ca.Mo.Zn.2H/q;+2;;;2*-1
InChIKeyVNCSWKMGILRXDW-UHFFFAOYSA-N
MW214.24 g/mol
LogP-0.54
Rot. Bonds

About CID 174907176

CID 174907176 (PubChem CID 174907176) has the molecular formula H2BCaMoZn and a molecular weight of 214.24 g/mol.

Molecular Properties

Compound NameCID 174907176
PubChem CID174907176
Molecular FormulaH2BCaMoZn
Molecular Weight214.24 g/mol
Exact Mass214.82
IUPAC Name—
SMILES[B].[Ca+2].[H-].[H-].[Mo].[Zn]
InChIInChI=1S/B.Ca.Mo.Zn.2H/q;+2;;;2*-1
InChIKeyVNCSWKMGILRXDW-UHFFFAOYSA-N
XLogP-0.54
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.24
LogP ≤ 5-0.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of CID 174907176?
The IUPAC name of CID 174907176 (CID 174907176) is not available.
What is the SMILES notation for CID 174907176?
The canonical SMILES for CID 174907176 is [B].[Ca+2].[H-].[H-].[Mo].[Zn].
What is the InChIKey of CID 174907176?
The InChIKey is VNCSWKMGILRXDW-UHFFFAOYSA-N. The full InChI is InChI=1S/B.Ca.Mo.Zn.2H/q;+2;;;2*-1.
What are the key properties of CID 174907176?
CID 174907176 has a molecular weight of 214.24 g/mol, XLogP of -0.54, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 174907176 is sourced from PubChem (CID 174907176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).