Geometry & MOs

Info

ID:	379090
PubChem CID:	134352334
Reduced:	NH37C50 (1)
Stoich.:	AB37C50 (1)
Weight, g/mol:	687.2926
ΔH_f, kcal/mol:	187.56
Dipole, Da:	1.37
IP(EA), eV:	-7.84(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-phenyl-N-[4-(7-phenylbenzo[a]phenalen-7-yl)phenyl]-N-(4-phenylphenyl)aniline

Drug info:

PubChemData

Smile

CC1(C2=CC=CC=C2C3=C1C=C(C=C3)N(C4=CC=CC=C4)C5=CC=CC(=C5)C6(C7=CC=CC=C7C8=CC=CC9=C8C6=CC=C9)C1=CC=CC=C1)C

DOS

IR

Vibrations