Geometry & MOs

Info

ID:	448314
PubChem CID:	135290067
Reduced:	O5C14H16 (1)
Stoich.:	A5B14C16 (1)
Weight, g/mol:	307.120843
ΔH_f, kcal/mol:	-146.04
Dipole, Da:	4.24
IP(EA), eV:	-8.82(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(2-methoxy-4-prop-2-ynoxyphenyl)-N-phenylprop-2-enamide

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)/C=C/C(=O)O)OCC2COC2

DOS

IR

Vibrations