Geometry & MOs

Info

ID:	340474
PubChem CID:	127262485
Reduced:	NO2C13H13 (1)
Stoich.:	AB2C13D13 (1)
Weight, g/mol:	355.02079
ΔH_f, kcal/mol:	-35.45
Dipole, Da:	1.01
IP(EA), eV:	-8.67(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-bromo-2-phenylphenyl) 2H-pyridine-1-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)OC(=O)N2CC=CC=C2

DOS

IR

Vibrations