Geometry & MOs

Info

ID:	402854
PubChem CID:	135057548
Reduced:	OC11H17 (2)
Stoich.:	AB11C17 (2)
Weight, g/mol:	442.263682
ΔH_f, kcal/mol:	-111.08
Dipole, Da:	7.91
IP(EA), eV:	-9.85(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclohexyl (E)-3-(2-dicyclohexylphosphorylphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CCCCCCCCCC[C@@]1(CCC2(C1)C=CC(=O)C=C2)C(=O)C

DOS

IR

Vibrations