Geometry & MOs

Info

ID:

26013

PubChem CID:

635880

Reduced:

O9H28C32 (1)

Stoich.:

A9B28C32 (1)

Weight, g/mol:

1092.744495

ΔHf, kcal/mol:

-346.04

Dipole, Da:

6.7

IP(EA), eV:

 -8.57(-0.74)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2,3,7,8,12,13,17,18-octaethyl-5-[2-(2,3,7,8,12,13,17,18-octaethyl-21,22,23,24-tetrahydroporphyrin-5-yl)ethenyl]porphyrin

Drug info:

PubChemData

Smile

CC1=CC2=C(C(=C1)O)C(=O)C3=C(C(=C(C=C3C2)OC)C4=C(C=C(C5=C4C=C6CC(CC(=O)C6=C5O)(C)O)O)OC)O

DOS

IR

Vibrations