Geometry & MOs

Info

ID:	237059
PubChem CID:	92717112
Reduced:	ClO2N4C23H25 (1)
Stoich.:	AB2C4D23E25 (1)
Weight, g/mol:	418.236876
ΔH_f, kcal/mol:	-22.1
Dipole, Da:	6.94
IP(EA), eV:	-8.74(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-1-(2,3-dimethylphenyl)-4-[1-(2-morpholin-4-ylethyl)benzimidazol-2-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1COCCN1CCN2C3=CC=CC=C3N=C2[C@H]4CC(=O)N(C4)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations