Geometry & MOs

Info

ID:	288161
PubChem CID:	104312337
Reduced:	BrNO2F3H9C13 (1)
Stoich.:	ABC2D3E9F13 (1)
Weight, g/mol:	298.97573
ΔH_f, kcal/mol:	-188.9
Dipole, Da:	4.12
IP(EA), eV:	-9.74(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromopyridin-2-yl)-(2,6-difluorophenyl)methanol

Drug info:

PubChemData

Smile

C1=CC=C(C(=C1)C(C2=C(C=CC=N2)Br)O)OC(F)(F)F

DOS

IR

Vibrations