Geometry & MOs

Info

ID:	366291
PubChem CID:	127319748
Reduced:	ON2C9H10 (2)
Stoich.:	AB2C9D10 (2)
Weight, g/mol:	392.14601
ΔH_f, kcal/mol:	-13.29
Dipole, Da:	4.49
IP(EA), eV:	-9.11(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(6,8-dihydro-5H-imidazo[1,2-a]pyrazine-7-carbonyl)-1-[[3-(trifluoromethyl)phenyl]methyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1CC1C(=O)NC2=CC=CC(=C2)C(=O)N3CCN4C=CN=C4C3

DOS

IR

Vibrations