Geometry & MOs

Info

ID:	259735
PubChem CID:	103173319
Reduced:	NO4C16H19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	353.02627
ΔH_f, kcal/mol:	-107.8
Dipole, Da:	6.81
IP(EA), eV:	-8.72(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-bromo-5-[(3,4-dimethoxypyridin-2-yl)methoxy]phenyl]methanol

Drug info:

PubChemData

Smile

C[C@H](C1=CC=C(C=C1)OCC2=NC=CC(=C2OC)OC)O

DOS

IR

Vibrations