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2D Structure
Also known as: Chromium polynicotinate, 64452-96-6, Chromium;pyridine-3-carboxylate
Molecular Formula
C6H4CrNO2-
Molecular Weight
174.10  g/mol
InChI Key
HPCCGRCEBFBZQP-UHFFFAOYSA-M

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
chromium;pyridine-3-carboxylate
2.1.2 InChI
InChI=1S/C6H5NO2.Cr/c8-6(9)5-2-1-3-7-4-5;/h1-4H,(H,8,9);/p-1
2.1.3 InChI Key
HPCCGRCEBFBZQP-UHFFFAOYSA-M
2.1.4 Canonical SMILES
C1=CC(=CN=C1)C(=O)[O-].[Cr]
2.2 Synonyms
2.2.1 MeSH Synonyms

1. Chromium Dinicotinate

2. Chromium Polynicotinate

2.2.2 Depositor-Supplied Synonyms

1. Chromium Polynicotinate

2. 64452-96-6

3. Chromium;pyridine-3-carboxylate

2.3 Create Date
2006-04-28
3 Chemical and Physical Properties
Molecular Weight 174.10 g/mol
Molecular Formula C6H4CrNO2-
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count3
Rotatable Bond Count0
Exact Mass173.964708 g/mol
Monoisotopic Mass173.964708 g/mol
Topological Polar Surface Area53 Ų
Heavy Atom Count10
Formal Charge-1
Complexity108
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2