Geometry & MOs

Info

ID:	199073
PubChem CID:	79194521
Reduced:	N2F3H11C12 (1)
Stoich.:	A2B3C11D12 (1)
Weight, g/mol:	225.072511
ΔH_f, kcal/mol:	-93.81
Dipole, Da:	6.97
IP(EA), eV:	-8.65(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-carbamoyl-3-(trifluoromethyl)pyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CNC1CCC2=C1C3=C(C(=C(C=C3N2)F)F)F

DOS

IR

Vibrations