Geometry & MOs

Info

ID:

53486

PubChem CID:

14716341

Reduced:

ON2H8C13 (1)

Stoich.:

AB2C8D13 (1)

Weight, g/mol:

826.149823

ΔHf, kcal/mol:

97.78

Dipole, Da:

2.64

IP(EA), eV:

-9.62(-2.79)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(4Z)-N-(2-chlorophenyl)-4-[[7-[(2Z)-2-[4-[(2-chlorophenyl)carbamoyl]-2-oxonaphthalen-1-ylidene]hydrazinyl]-9-oxofluoren-2-yl]hydrazinylidene]-3-oxonaphthalene-2-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=NC#N)C=CC1=C2C=CC(=O)C=C2

DOS

IR

Vibrations