Geometry & MOs

Info

ID:	29607
PubChem CID:	835758
Reduced:	BrNO2H14C15 (1)
Stoich.:	ABC2D14E15 (1)
Weight, g/mol:	309.95085
ΔH_f, kcal/mol:	-36.98
Dipole, Da:	3.73
IP(EA), eV:	-9.02(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-(2-chlorophenyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=CC=C(C=C1)Br)OC2=CC=CC=C2

DOS

IR

Vibrations