Geometry & MOs

Info

ID:

432924

PubChem CID:

135173061

Reduced:

O9C26H36 (1)

Stoich.:

A9B26C36 (1)

Weight, g/mol:

740.295651

ΔHf, kcal/mol:

-347.61

Dipole, Da:

5.02

IP(EA), eV:

 -9.19(-1.42)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

5-[4-[cyclohexa-1,5-dien-1-yl(phenyl)phosphoryl]phenyl]-3-naphthalen-1-yl-8-phenylspiro[4,6-diazatricyclo[9.4.0.02,7]pentadeca-1(15),2,4,6,11,13-hexaene-9,5'-cyclohexa-1,3-diene]

Drug info:

PubChemData

Smile

COCCCCOC(=O)C1=C(C=CC(=C1)C(=O)OCCCCOC=C)C(=O)OCCCCOC=C

DOS

IR

Vibrations