Chemical Components in the PDB

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EMC : Summary

Code

EMC

One-letter code

X

Molecule name

ETHYL MERCURY ION

Systematic names

ProgramVersionName
ACDLabs 10.04 ethylmercury(1+)
OpenEye OEToolkits 1.5.0 ethylmercury

Formula

C2 H5 Hg

Formal charge

1

Molecular weight

229.651 Da

SMILES

TypeProgramVersionDescriptor
SMILES ACDLabs 10.04 [Hg+]CC
SMILES CACTVS 3.341 CC[Hg+]
SMILES OpenEye OEToolkits 1.5.0 CC[Hg+]
Canonical SMILES CACTVS 3.341 CC[Hg+]
Canonical SMILES OpenEye OEToolkits 1.5.0 CC[Hg+]

IUPAC InChI

InChI=1S/C2H5.Hg/c1-2;/h1H2,2H3;/q;+1

IUPAC InChI key

MJOUBOKSWBMNGQ-UHFFFAOYSA-N
EMC

wwPDB Information

Atom count

8 (3 without Hydrogen)

Polymer type

Bound ligand

Type description

NON-POLYMER

Type code

HETAI

Is modified

No

Standard parent

Not Assigned

Defined at

1999-07-08

Last modified at

2011-06-04

Status

Released

Obsoleted

Not Assigned