Geometry & MOs

Info

ID:	145989
PubChem CID:	53621329
Reduced:	N2F3O3H19C20 (1)
Stoich.:	A2B3C3D19E20 (1)
Weight, g/mol:	342.01162
ΔH_f, kcal/mol:	-226.48
Dipole, Da:	7.4
IP(EA), eV:	-9.21(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-N-[3-(1H-imidazol-2-yl)phenyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CN(C1=CC=CC=C1OC2=CC=CC=C2)C(=O)C3CC(=O)N(C3)CC(F)(F)F

DOS

IR

Vibrations