Geometry & MOs

Info

ID:	55104
PubChem CID:	17389769
Reduced:	N2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	306.03829
ΔH_f, kcal/mol:	-81.11
Dipole, Da:	7.48
IP(EA), eV:	-8.77(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-chloro-5-(trifluoromethyl)phenyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)NC(=O)C2CCC(=O)N2)C

DOS

IR

Vibrations