FC6

HEXACYANOFERRATE(3-)

Created:	2006-10-19
Last modified:	2021-03-01

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20 entries where FC6 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	13
Chiral Atom Count	0
Bond Count	12
Aromatic Bond Count	0

2D diagram of FC6

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Chemical Component Summary
Name	HEXACYANOFERRATE(3-)
Synonyms	FERRI(III)HEXACYANIDE
Systematic Name (OpenEye OEToolkits)	hexacyanoiron
Formula	C₆ Fe N₆
Molecular Weight	211.949
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	10.04	N#C[Fe](C#N)(C#N)(C#N)(C#N)C#N
SMILES	CACTVS	3.341	N#C[Fe](C#N)(C#N)(C#N)(C#N)C#N
SMILES	OpenEye OEToolkits	1.5.0	C(#N)[Fe](C#N)(C#N)(C#N)(C#N)C#N
Canonical SMILES	CACTVS	3.341	N#C[Fe](C#N)(C#N)(C#N)(C#N)C#N
Canonical SMILES	OpenEye OEToolkits	1.5.0	C(#N)[Fe](C#N)(C#N)(C#N)(C#N)C#N
InChI	InChI	1.03	InChI=1S/6CN.Fe/c6*1-2;
InChIKey	InChI	1.03	HCMVSLMENOCDCK-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	138398262
CCDC/CSD	BUWMAJ, COENCF01, CEJYEV, BIWYOW, BAMBAV, AZEGAO, CAWKIX, CIWJOH01, CIWJOH10, COHMOB, AKAMUU, ANEGEG, BPCOFC10, AKAMOO, ANEGIK

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.