Geometry & MOs

Info

ID:

411996

PubChem CID:

135084859

Reduced:

P2O8H38C41 (1)

Stoich.:

A2B8C38D41 (1)

Weight, g/mol:

856.138988

ΔHf, kcal/mol:

-266.04

Dipole, Da:

5.95

IP(EA), eV:

 -8.4(-0.54)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

[7-bis(3,5-difluorophenyl)phosphanyloxy-6-phenoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl]oxy-bis(3,5-difluorophenyl)phosphane

Drug info:

PubChemData

Smile

CC1=CC2=CC=CC=C2C(=C1OPOC3=CC=CC=C3C4OCCCO4)C5=C(C=CC6=CC=CC=C65)OPOC7=CC=CC=C7C8OCCCO8

DOS

IR

Vibrations