Geometry & MOs

Info

ID:	329029
PubChem CID:	126730648
Reduced:	Cl2N10C21H26 (1)
Stoich.:	A2B10C21D26 (1)
Weight, g/mol:	758.340947
ΔH_f, kcal/mol:	116.33
Dipole, Da:	3.14
IP(EA), eV:	-8.47(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-[4-[4-[2,6-bis(2-methylphenyl)pyrimidin-4-yl]phenyl]-3-methylphenyl]-N,N-diphenylcarbazol-3-amine

Drug info:

PubChemData

Smile

CC(CNC1=NC(N=C(N1)Cl)NC2=CC=CC=C2)NC3NC(N=C(N3)Cl)NC4=CC=CC=C4

DOS

IR

Vibrations