Geometry & MOs

Info

ID:	399581
PubChem CID:	135041082
Reduced:	OC12H20 (1)
Stoich.:	AB12C20 (1)
Weight, g/mol:	268.109944
ΔH_f, kcal/mol:	-24.05
Dipole, Da:	1.88
IP(EA), eV:	-9.08(1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(E)-3-hydroxy-3-(2-methoxyphenyl)prop-1-enyl]benzaldehyde

Drug info:

PubChemData

Smile

CC(=CCC[C@@]1([C@@H](O1)CC=C)C)C

DOS

IR

Vibrations