Geometry & MOs

Info

ID:	340782
PubChem CID:	127262794
Reduced:	PO3C39H53 (1)
Stoich.:	AB3C39D53 (1)
Weight, g/mol:	550.284811
ΔH_f, kcal/mol:	-144.7
Dipole, Da:	3.51
IP(EA), eV:	-7.63(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dicyclohexyl-[1,4-dimethoxy-3-(2,4,6-trimethoxyphenyl)naphthalen-2-yl]phosphane

Drug info:

PubChemData

Smile

CC(C)OC1=CC(=C(C(=C1C2=CC=CC=C2)OC(C)C)C3=CC=CC=C3P(C4CCCCC4)C5CCCCC5)OC(C)C

DOS

IR

Vibrations