Geometry & MOs

Info

ID:	194443
PubChem CID:	78537179
Reduced:	NF2O3H13C16 (1)
Stoich.:	AB2C3D13E16 (1)
Weight, g/mol:	287.059386
ΔH_f, kcal/mol:	-175.49
Dipole, Da:	5.0
IP(EA), eV:	-9.06(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-nitrophenyl) 3-(4-fluorophenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)F)OC(=O)C2=CC(=CC=C2)F

DOS

IR

Vibrations