Geometry & MOs

Info

ID:	272748
PubChem CID:	103754415
Reduced:	BrFO2N3H9C13 (1)
Stoich.:	ABC2D3E9F13 (1)
Weight, g/mol:	286.03169
ΔH_f, kcal/mol:	-72.0
Dipole, Da:	5.77
IP(EA), eV:	-9.52(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(1-methoxypropan-2-yl)-N-methylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1NC(=O)C2=CC(=NC=C2)Br)C(=O)N)F

DOS

IR

Vibrations