Geometry & MOs

Info

ID:	449545
PubChem CID:	135299464
Reduced:	NH31C48 (1)
Stoich.:	AB31C48 (1)
Weight, g/mol:	288.070578
ΔH_f, kcal/mol:	207.45
Dipole, Da:	0.62
IP(EA), eV:	-7.89(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chlorophenyl)phenanthrene

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=CC3=C2C4=C(C=CC=C4N(C5=CC6=C(C=C5)C7=CC=CC=C7C=C6)C8=CC9=C(C=C8)C1=CC=CC=C1C=C9)C=C3

DOS

IR

Vibrations