Geometry & MOs

Info

ID:	25687
PubChem CID:	629006
Reduced:	OCl2N2C23H24 (1)
Stoich.:	AB2C2D23E24 (1)
Weight, g/mol:	318.140851
ΔH_f, kcal/mol:	0.4
Dipole, Da:	6.34
IP(EA), eV:	-9.2(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

9-(naphthalen-1-ylmethyl)phenanthrene

Drug info:

PubChemData

Smile

CCCCCCCCC1=CC(=C2C=C(C=C(C2=N1)Cl)Cl)C(=O)C3=CC=CC=N3

DOS

IR

Vibrations