Geometry & MOs

Info

ID:	288160
PubChem CID:	104312274
Reduced:	BrON3H10C11 (1)
Stoich.:	ABC3D10E11 (1)
Weight, g/mol:	346.97688
ΔH_f, kcal/mol:	9.58
Dipole, Da:	3.77
IP(EA), eV:	-9.11(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromopyridin-2-yl)-[2-(trifluoromethoxy)phenyl]methanol

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)C(C2=C(C=CN=C2)N)O)Br

DOS

IR

Vibrations