Geometry & MOs

Info

ID:	268135
PubChem CID:	103598004
Reduced:	N2O3C20H24 (1)
Stoich.:	A2B3C20D24 (1)
Weight, g/mol:	392.11479
ΔH_f, kcal/mol:	-59.66
Dipole, Da:	1.69
IP(EA), eV:	-8.22(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-cyanophenyl)methyl]-3-(3-fluoro-4-methoxyphenyl)-N-(2,2,2-trifluoroethyl)prop-2-enamide

Drug info:

PubChemData

Smile

CN(C)CCOC1=CC=C(C=C1)NC(=O)C=CC2=CC(=CC=C2)OC

DOS

IR

Vibrations