Geometry & MOs

Info

ID:	237069
PubChem CID:	92717148
Reduced:	O2N4C25H30 (1)
Stoich.:	A2B4C25D30 (1)
Weight, g/mol:	418.236876
ΔH_f, kcal/mol:	-27.47
Dipole, Da:	4.43
IP(EA), eV:	-8.8(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R)-1-(2,5-dimethylphenyl)-4-[1-(2-morpholin-4-ylethyl)benzimidazol-2-yl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)N2C[C@H](CC2=O)C3=NC4=CC=CC=C4N3CCN5CCOCC5

DOS

IR

Vibrations