Geometry & MOs

Info

ID:	183568
PubChem CID:	77042073
Reduced:	ClON4C11H15 (1)
Stoich.:	ABC4D11E15 (1)
Weight, g/mol:	288.119796
ΔH_f, kcal/mol:	-18.4
Dipole, Da:	2.5
IP(EA), eV:	-8.62(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-amino-3-(trifluoromethyl)phenyl]-3-methylpyrazolidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1C(CNN1)C(=O)NC2=CC(=C(C=C2)Cl)N

DOS

IR

Vibrations