Geometry & MOs

Info

ID:	122877
PubChem CID:	50825211
Reduced:	SN4O5C23H26 (1)
Stoich.:	AB4C5D23E26 (1)
Weight, g/mol:	462.172562
ΔH_f, kcal/mol:	-107.83
Dipole, Da:	3.82
IP(EA), eV:	-8.66(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-4-[1-methyl-5-[(2,4,6-trimethylphenyl)sulfonylamino]benzimidazol-2-yl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)CCC2=NC(=NO2)C3=CC=C(C=C3)S(=O)(=O)N4CCOCC4)C

DOS

IR

Vibrations