Geometry & MOs

Info

ID:	300506
PubChem CID:	121360347
Reduced:	N4H28C43 (1)
Stoich.:	A4B28C43 (1)
Weight, g/mol:	429.155121
ΔH_f, kcal/mol:	222.5
Dipole, Da:	3.85
IP(EA), eV:	-8.18(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(4-anilino-3-phenylphenyl)-2-phenylbenzenethiol

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C=CN2C3=CC4=C(C=C3)N(C5=C4C=C(C=C5)C6=CC(=CC=C6)N7C8=CC=CC=C8C9=CC=CC=C97)C1=CC=CC=N1

DOS

IR

Vibrations