Geometry & MOs

Info

ID:	126862
PubChem CID:	50982354
Reduced:	ON3C17H17 (1)
Stoich.:	AB3C17D17 (1)
Weight, g/mol:	382.179361
ΔH_f, kcal/mol:	50.03
Dipole, Da:	6.14
IP(EA), eV:	-9.11(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-[(4-phenyl-5-quinolin-8-ylimidazol-1-yl)methyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

C1COCCN1CC2=CC=CC=C2C3=CN=C(C=C3)C#N

DOS

IR

Vibrations