Geometry & MOs

Info

ID:	18217
PubChem CID:	538947
Reduced:	OC26H40 (1)
Stoich.:	AB26C40 (1)
Weight, g/mol:	368.307916
ΔH_f, kcal/mol:	-47.29
Dipole, Da:	5.97
IP(EA), eV:	-8.79(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-methyl-6-(2,6,6-trimethylcyclohexen-1-yl)hexa-1,3,5-trienyl]dec-2-enal

Drug info:

PubChemData

Smile

CCCCCCCC(=CC=O)C=CC=C(C)C=CC1=C(CCCC1(C)C)C

DOS

IR

Vibrations