Geometry & MOs

Info

ID:	273209
PubChem CID:	103770689
Reduced:	BrFNO2C12H15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	286.03169
ΔH_f, kcal/mol:	-126.84
Dipole, Da:	2.34
IP(EA), eV:	-10.05(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-(2-hydroxypentyl)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CCCC(CNC(=O)C1=CC(=C(C=C1)F)Br)O

DOS

IR

Vibrations