Geometry & MOs

Info

ID:

436361

PubChem CID:

135199342

Reduced:

FNO5C21H32 (1)

Stoich.:

ABC5D21E32 (1)

Weight, g/mol:

700.320212

ΔHf, kcal/mol:

-296.11

Dipole, Da:

2.3

IP(EA), eV:

 -8.76(0.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

N-methyl-2-[3-[[3-[(Z)-3-methylimino-1-[6-methyl-3-(1,10-phenanthrolin-4-yl)cyclohexa-2,4-dien-1-yl]prop-1-en-2-yl]phenyl]methyl]dibenzofuran-4-yl]aniline

Drug info:

PubChemData

Smile

C[C@@H]([C@H](C1=CC(=C(C=C1)OC)F)C(C)C)OC(=O)[C@H](C)NC(=O)OC(C)(C)C

DOS

IR

Vibrations