Geometry & MOs

Info

ID:

439483

PubChem CID:

135229257

Reduced:

N6H28C43 (1)

Stoich.:

A6B28C43 (1)

Weight, g/mol:

622.309647

ΔHf, kcal/mol:

260.06

Dipole, Da:

4.1

IP(EA), eV:

 -8.82(-1.0)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[3-[3-[3-[8-(ethylideneamino)-7-methylquinolin-2-yl]phenyl]phenyl]phenyl]-N,N-dimethyl-7-[(Z)-prop-1-enyl]quinolin-8-amine

Drug info:

PubChemData

Smile

C/C=C\C1=C(N=CC=C1)C2=CC=CC(=N2)C3=CC(=CC(=C3)C4=NC5=C(C=CC6=C5N=CC=C6)C=C4)C7=NC8=C(C=CC9=C8N=CC=C9)C=C7

DOS

IR

Vibrations