PDB Chemical Component NCO

Ideal Model

Chemical Description

Name COBALT HEXAMMINE(III)
Formula Co H18 N6
Formal charge 3
Molecular weight 161.116 g/mol
Component type NON-POLYMER
Ambiguous Chemistry Warning The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution.

Chemical features

Atom count 25
Chiral atom count 0
Bond count 24
Aromatic bond count 0

Chemical Descriptors

Stereo SMILES (CACTVS) N|[Co+3](|N)(|N)(|N)(|N)|N
SMILES (CACTVS) N|[Co+3](|N)(|N)(|N)(|N)|N
Stereo SMILES (OpenEye) [NH3][Co+3]([NH3])([NH3])([NH3])([NH3])[NH3]
InChI descriptor InChI=1/Co.6H3N/h;6*1H3/q+3;;;;;;/rCoH18N6/c2-1(3,4,5,6)7/h2-7H3/q+3
InChIKey descriptor DYLMFCCYOUSRTK-FGTKAUEHAT

Status Information

Last modified 2008-12-19
Created 1999-07-08
Release status REL
Model PDB code 1D8X
Processing site RCSB