Geometry & MOs

Info

ID:	66010
PubChem CID:	46488104
Reduced:	N2O5H18C20 (1)
Stoich.:	A2B5C18D20 (1)
Weight, g/mol:	391.099063
ΔH_f, kcal/mol:	-140.25
Dipole, Da:	6.18
IP(EA), eV:	-8.57(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(benzenesulfonylmethyl)-N-(1H-benzimidazol-2-yl)benzamide

Drug info:

PubChemData

Smile

COC1=CC2=C(C=C1)C(=O)C(=CN2)C(=O)NCC3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations