Geometry & MOs

Info

ID:	440303
PubChem CID:	135230250
Reduced:	SN4O7C25H42 (1)
Stoich.:	AB4C7D25E42 (1)
Weight, g/mol:	266.014143
ΔH_f, kcal/mol:	-320.56
Dipole, Da:	4.46
IP(EA), eV:	-9.38(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-3-(1-methyltetrazol-5-yl)-1H-benzimidazole-2-thione

Drug info:

PubChemData

Smile

CCC(C=C)(C(=O)NS(=O)(=O)C1CC1)NC(=O)C2CCCN2C(=O)[C@H](C(C)(C)C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations