Geometry & MOs

Info

ID:	150455
PubChem CID:	53790145
Reduced:	NO2H21C24 (1)
Stoich.:	AB2C21D24 (1)
Weight, g/mol:	268.109944
ΔH_f, kcal/mol:	17.71
Dipole, Da:	5.02
IP(EA), eV:	-8.79(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxy-4-phenylmethoxyphenyl)prop-2-enal

Drug info:

PubChemData

Smile

CC(C#N)(C1=CC=CC=C1)OC2=CC=C(C=C2)C3CCOC4=CC=CC=C34

DOS

IR

Vibrations