Geometry & MOs

Info

ID:	329582
PubChem CID:	126738599
Reduced:	N2H42C51 (1)
Stoich.:	A2B42C51 (1)
Weight, g/mol:	650.272199
ΔH_f, kcal/mol:	179.9
Dipole, Da:	3.23
IP(EA), eV:	-7.87(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-methylphenyl)-9-(4-phenylphenyl)-N-triphenylen-1-ylcarbazol-2-amine

Drug info:

PubChemData

Smile

CC1CC=C(C=C1)C2=CCC(C(=C2)N3C4=CC=CC=C4C5=C3C=C(C=C5)N(C6=CC=C(C=C6)C)C7=CC=CC8=C7C9=CC=CC=C9C1=CC=CC=C81)C

DOS

IR

Vibrations