Geometry & MOs

Info

ID:	340770
PubChem CID:	127262782
Reduced:	PO4C31H39 (1)
Stoich.:	AB4C31D39 (1)
Weight, g/mol:	598.300068
ΔH_f, kcal/mol:	-153.17
Dipole, Da:	3.73
IP(EA), eV:	-8.59(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[4-(2-dicyclohexylphosphorylphenyl)phenyl]phenyl]-8-methoxynaphthalene

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=C(C3=CC=CC=C3C(=C2P(=O)(C4CCCCC4)C5CCCCC5)OC)OC

DOS

IR

Vibrations