Geometry & MOs

Info

ID:	235522
PubChem CID:	92709917
Reduced:	ClO2N4H19C24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	430.119654
ΔH_f, kcal/mol:	15.84
Dipole, Da:	1.99
IP(EA), eV:	-8.76(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4S)-N-(2-chlorophenyl)-4-(3-hydroxyphenyl)-2-methyl-1,4-dihydropyrimido[1,2-a]benzimidazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=C([C@H](N2C3=CC=CC=C3N=C2N1)C4=CC(=CC=C4)O)C(=O)NC5=CC=CC=C5Cl

DOS

IR

Vibrations