Geometry & MOs

Info

ID:	407381
PubChem CID:	135079960
Reduced:	ON2C27H34 (1)
Stoich.:	AB2C27D34 (1)
Weight, g/mol:	502.319543
ΔH_f, kcal/mol:	32.21
Dipole, Da:	10.27
IP(EA), eV:	-9.39(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,2Z,10E)-2-[2-(3,5-dimethoxyphenyl)ethylidene]-6-methyl-10-[(E)-4-methyl-9-oxonon-3-enylidene]undec-5-enedinitrile

Drug info:

PubChemData

Smile

C/C(=C\CCC1=CC=C(C=C1)C#N)/CCC/C(=C\C/C=C(\C)/CCCCC=O)/C#N

DOS

IR

Vibrations