Geometry & MOs

Info

ID:	246641
PubChem CID:	103064158
Reduced:	SN2O3C11H18 (1)
Stoich.:	AB2C3D11E18 (1)
Weight, g/mol:	288.093249
ΔH_f, kcal/mol:	-143.96
Dipole, Da:	2.28
IP(EA), eV:	-8.69(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-1-(thiolan-3-yl)benzimidazole-4-carboxylic acid

Drug info:

PubChemData

Smile

C1CC(C1)(CC(=O)O)NC(=O)NC2CCSC2

DOS

IR

Vibrations