Geometry & MOs

Info

ID:	219218
PubChem CID:	85096576
Reduced:	O9C24H32 (1)
Stoich.:	A9B24C32 (1)
Weight, g/mol:	464.232776
ΔH_f, kcal/mol:	-361.52
Dipole, Da:	4.14
IP(EA), eV:	-9.57(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diethyl [6-[2-(methoxymethoxy)-5-prop-2-enylphenyl]-2-methyl-5-prop-1-en-2-ylcyclohexen-1-yl] phosphate

Drug info:

PubChemData

Smile

CC1C(C(C2(C(C13CC(OC3O)C4=COC=C4)CCCC25CO5)COC(=O)C)O)OC(=O)C

DOS

IR

Vibrations