Geometry & MOs

Info

ID:	60350
PubChem CID:	26683867
Reduced:	S2N3O3C26H31 (1)
Stoich.:	A2B3C3D26E31 (1)
Weight, g/mol:	336.12224
ΔH_f, kcal/mol:	-84.07
Dipole, Da:	2.87
IP(EA), eV:	-8.59(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-4-(2-oxopyrrolidin-1-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N3CCC[C@H]3C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations