Chemical Components in the PDB

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NCO : Summary

Code

NCO

One-letter code

X

Molecule name

COBALT HEXAMMINE(III)

Systematic names

Not Assigned

Formula

Co H18 N6

Formal charge

3

Molecular weight

161.116 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.341 N|[Co+3](|N)(|N)(|N)(|N)|N
SMILES OpenEye OEToolkits 1.5.0 [NH3][Co+3]([NH3])([NH3])([NH3])([NH3])[NH3]
Canonical SMILES CACTVS 3.341 N|[Co+3](|N)(|N)(|N)(|N)|N
Canonical SMILES OpenEye OEToolkits 1.5.0 [NH3][Co+3]([NH3])([NH3])([NH3])([NH3])[NH3]

IUPAC InChI

InChI=1/Co.6H3N/h;6*1H3/q+3;;;;;;/rCoH18N6/c2-1(3,4,5,6)7/h2-7H3/q+3

IUPAC InChI key

DYLMFCCYOUSRTK-FGTKAUEHAT
NCO

wwPDB Information

Atom count

25 (7 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAC

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2008-12-19

Status

Released

Obsoleted

Not Assigned