Geometry & MOs

Info

ID:	225252
PubChem CID:	85752920
Reduced:	OCl3H7C14 (1)
Stoich.:	AB3C7D14 (1)
Weight, g/mol:	348.02621
ΔH_f, kcal/mol:	-7.56
Dipole, Da:	4.07
IP(EA), eV:	-9.37(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(bromomethyl)phenyl]-1,10-phenanthroline

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C3=C(C2(C(=O)Cl)Cl)C=C(C=C3)Cl

DOS

IR

Vibrations