Geometry & MOs

Info

ID:	65225
PubChem CID:	29204637
Reduced:	N2O3C23H28 (1)
Stoich.:	A2B3C23D28 (1)
Weight, g/mol:	364.103477
ΔH_f, kcal/mol:	-82.58
Dipole, Da:	6.03
IP(EA), eV:	-8.27(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-acetamido-3-phenyl-N-[4-(trifluoromethoxy)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)[C@H](CNC(=O)C(C)C)C2=CNC3=CC=CC=C32)OC

DOS

IR

Vibrations