Chemical Components in the PDB

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NRU : Summary

Code

NRU

One-letter code

X

Molecule name

RUTHENIUM (III) HEXAAMINE ION

Synonyms

HEXAAMINORUTHENIUM

Systematic names

ProgramVersionName
OpenEye OEToolkits 2.0.7 hexakis($l^{4}-azanyl)ruthenium(3+)

Formula

H18 N6 Ru

Formal charge

3

Molecular weight

203.253 Da

SMILES

TypeProgramVersionDescriptor
SMILES CACTVS 3.385 N.N.N.N.N.N.[Ru+3]
SMILES OpenEye OEToolkits 2.0.7 [NH3][Ru+3]([NH3])([NH3])([NH3])([NH3])[NH3]
Canonical SMILES CACTVS 3.385 N.N.N.N.N.N.[Ru+3]
Canonical SMILES OpenEye OEToolkits 2.0.7 [NH3][Ru+3]([NH3])([NH3])([NH3])([NH3])[NH3]

IUPAC InChI

InChI=1S/6H3N.Ru/h6*1H3;/q;;;;;;+3

IUPAC InChI key

HOOVQFBYNWLMGV-UHFFFAOYSA-N
NRU

wwPDB Information

Atom count

25 (7 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAIN

Is modified

No

Standard parent

Not Assigned

Defined at

2006-07-28

Last modified at

2023-09-23

Status

Released

Obsoleted

Not Assigned