Geometry & MOs

Info

ID:	49015
PubChem CID:	11528616
Reduced:	OF3C11H11 (1)
Stoich.:	AB3C11D11 (1)
Weight, g/mol:	216.089878
ΔH_f, kcal/mol:	-168.8
Dipole, Da:	3.26
IP(EA), eV:	-9.04(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(prop-2-enoylamino)phenyl]prop-2-enamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C(C=C)C(F)(F)F

DOS

IR

Vibrations