ISDA: 5AUK

Atom Indices

Bond Indices

Highlight Substructure

Structural Complex

Chemical ID: GAK

IUPAC Name: [2Ga-2S] cluster

Formal Charge: 2

Type: NON-POLYMER

Substructure

Substruture Type: MurckoScaffold

SMILES: [S-2]1[Ga+3][S-2][Ga+3]1

InChI: InChI=1S/2Ga.2S/q2*+3;2*-2

InChI Key: LWUUBMGSTPXMIG-UHFFFAOYSA-N

Physiochemical Descriptor:

Formula: Ga2 S2

Molecular weight: 203.576

Hydrogen Bond Acceptor: 2

Hydrogen Bond Donor: 0

Rotatable Bonds: 0

Heavy Atoms: 4

Systematic name

Program	Version	Descriptor
OpenEye OEToolkits	1.9.2	1,3,2$l^{2},4$l^{2}-dithiadigalletane

Chemical Descriptors

Type	Program	Version	Descriptor
InChI	InChI	1.03	InChI=1S/2Ga.2S.2H
InChIKey	InChI	1.03	VXAXRCXBFUALTA-UHFFFAOYSA-N
SMILES_CANONICAL	CACTVS	3.385	S1[Ga]S[Ga]1
SMILES	CACTVS	3.385	S1[Ga]S[Ga]1
SMILES_CANONICAL	OpenEye OEToolkits	1.9.2	S1[Ga]S[Ga]1
SMILES	OpenEye OEToolkits	1.9.2	S1[Ga]S[Ga]1