Geometry & MOs

Info

ID:	226644
PubChem CID:	87550954
Reduced:	PO7C19H19 (1)
Stoich.:	AB7C19D19 (1)
Weight, g/mol:	292.167459
ΔH_f, kcal/mol:	-205.3
Dipole, Da:	7.93
IP(EA), eV:	-8.93(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-5-[4-methoxy-3-(3-methoxypropoxy)phenyl]-3-methylpent-4-enal

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C2=C(C(=O)C3=C(O2)C=C(C=C3OC)OCP=O)OC

DOS

IR

Vibrations