1CL

FE(8)-S(7) CLUSTER, OXIDIZED

Created:	2011-11-22
Last modified:	2011-11-28

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8 entries where 1CL is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	15
Chiral Atom Count	0
Bond Count	22
Aromatic Bond Count	0

2D diagram of 1CL

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Chemical Component Summary
Name	FE(8)-S(7) CLUSTER, OXIDIZED
Formula	Fe₈ S₇
Molecular Weight	671.215
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.370	[Fe]\|1\|2S\|3[Fe]S\|1[Fe]S\|2[Fe]\|3[S]45[Fe]\|6S\|7[Fe]\|8S\|6[Fe]4S\|8[Fe]5\|7
SMILES	OpenEye OEToolkits	1.7.6	[S]12[Fe][S]3[Fe]1[S]([Fe]2)[Fe]3S45[Fe]6[S]7[Fe]4[S]8[Fe]7[S]6[Fe]58
Canonical SMILES	CACTVS	3.370	[Fe]\|1\|2S\|3[Fe]S\|1[Fe]S\|2[Fe]\|3[S]45[Fe]\|6S\|7[Fe]\|8S\|6[Fe]4S\|8[Fe]5\|7
Canonical SMILES	OpenEye OEToolkits	1.7.6	[S]12[Fe][S]3[Fe]1[S]([Fe]2)[Fe]3S45[Fe]6[S]7[Fe]4[S]8[Fe]7[S]6[Fe]58
InChI	InChI	1.03	InChI=1S/8Fe.7S
InChIKey	InChI	1.03	JKVMXLBGZBULKV-UHFFFAOYSA-N

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.