Geometry & MOs

Info

ID:	378009
PubChem CID:	134224077
Reduced:	BrNCl2O3H14C23 (1)
Stoich.:	ABC2D3E14F23 (1)
Weight, g/mol:	496.84485
ΔH_f, kcal/mol:	-44.59
Dipole, Da:	4.11
IP(EA), eV:	-9.54(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-6-(3,5-dibromo-2-phenylmethoxyphenyl)pyridine

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CN2C3=C(C=CC(=C3)Br)C(=C2C(=O)O)C(=O)C4=CC=C(C=C4)Cl)Cl

DOS

IR

Vibrations