Geometry & MOs

Info

ID:	121863
PubChem CID:	50784548
Reduced:	ClSN4O4C22H25 (1)
Stoich.:	ABC4D4E22F25 (1)
Weight, g/mol:	417.099457
ΔH_f, kcal/mol:	-121.39
Dipole, Da:	4.45
IP(EA), eV:	-8.9(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-benzodioxol-5-ylmethyl)-2-(1,3-dimethyl-2-oxobenzimidazol-5-yl)sulfonylacetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)Cl)N2CCN(CC2)C(=O)CS(=O)(=O)C3=CC4=C(C=C3)N(C(=O)N4C)C

DOS

IR

Vibrations