Geometry & MOs

Info

ID:	442497
PubChem CID:	135252486
Reduced:	ON9C26H29 (1)
Stoich.:	AB9C26D29 (1)
Weight, g/mol:	934.378396
ΔH_f, kcal/mol:	118.58
Dipole, Da:	7.21
IP(EA), eV:	-8.69(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-phenyl-N-[4-[9-phenyl-6-[4-(N-phenylanilino)phenyl]carbazol-3-yl]phenyl]-4-(4-pyrido[2,3-d]pyridazin-8-ylphenyl)aniline

Drug info:

PubChemData

Smile

CC(C)CCC(=O)N1CCN(CC1)C2=NC=C(C=C2)C3=NC(=CN4C3=C(C=N4)C#N)C5=CN(N=C5)C

DOS

IR

Vibrations