Geometry & MOs

Info

ID:	240638
PubChem CID:	93616911
Reduced:	NSO4C12H17 (1)
Stoich.:	ABC4D12E17 (1)
Weight, g/mol:	309.114713
ΔH_f, kcal/mol:	-159.2
Dipole, Da:	4.17
IP(EA), eV:	-8.69(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-methylsulfonyl-N-(1-propylbenzimidazol-2-yl)propanamide

Drug info:

PubChemData

Smile

CCOC1=CC=CC=C1NC(=O)[C@@H](C)S(=O)(=O)C

DOS

IR

Vibrations