Geometry & MOs

Info

ID:

436343

PubChem CID:

135199170

Reduced:

N2O5C26H34 (1)

Stoich.:

A2B5C26D34 (1)

Weight, g/mol:

723.361348

ΔHf, kcal/mol:

-194.4

Dipole, Da:

7.7

IP(EA), eV:

 -8.85(-0.73)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-methyl-10-[(3Z,5Z,10Z,12E)-6-methyl-12-[4-(1,10-phenanthrolin-4-yl)naphthalen-1-yl]pentadeca-1,3,5,10,12,14-hexaen-5-yl]phenanthren-9-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)[C@@H](C2CCCC2)[C@H](C)OC(=O)[C@H](C)NC(=O)C3=NC=CC(=C3O)OC)C

DOS

IR

Vibrations