Geometry & MOs

Info

ID:	316713
PubChem CID:	126631622
Reduced:	FO2N8C22H31 (1)
Stoich.:	AB2C8D22E31 (1)
Weight, g/mol:	1355.544399
ΔH_f, kcal/mol:	-56.89
Dipole, Da:	4.98
IP(EA), eV:	-8.53(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[4-[2,4-bis[4-[3-(N-phenylanilino)carbazol-9-yl]phenyl]quinazolin-6-yl]phenyl]-N,N-diphenylcarbazol-3-amine

Drug info:

PubChemData

Smile

CNC(=O)[C@H]1C[C@H](CCN1)NC(=O)CN2CCN(CC2)C3=NC(=CNN3)C4=CC=C(C=C4)F

DOS

IR

Vibrations