Geometry & MOs

Info

ID:	163940
PubChem CID:	74381001
Reduced:	O3N5C30H35 (1)
Stoich.:	A3B5C30D35 (1)
Weight, g/mol:	523.169446
ΔH_f, kcal/mol:	-33.36
Dipole, Da:	2.65
IP(EA), eV:	-9.0(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenyl-5-[3-(trifluoromethoxy)phenyl]-3-[2-[6-(trifluoromethyl)pyridin-3-yl]propan-2-ylamino]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CN1CCCCC1C2=NC3=C(N2C4=CC=C(C=C4)CC(C(=O)O)NC5=CC(=O)C56CCCCC6)N=CC=C3

DOS

IR

Vibrations