Geometry & MOs

Info

ID:	312805
PubChem CID:	126608837
Reduced:	SN3O3H21C22 (1)
Stoich.:	AB3C3D21E22 (1)
Weight, g/mol:	414.172562
ΔH_f, kcal/mol:	-37.09
Dipole, Da:	10.2
IP(EA), eV:	-9.04(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[6-(1,5-dimethyl-6-oxopyridin-3-yl)-2-methyl-1-[(1-methylcyclopropyl)methyl]benzimidazol-4-yl]methanesulfonamide

Drug info:

PubChemData

Smile

CC1=CC(=CN(C1=O)C)C2=CC3=C(N2CC4=CN=CC=C4)C=CC=C3S(=O)(=O)C

DOS

IR

Vibrations