Geometry & MOs

Info

ID:	373215
PubChem CID:	131311705
Reduced:	BrSO2C11H11 (1)
Stoich.:	ABC2D11E11 (1)
Weight, g/mol:	242.00699
ΔH_f, kcal/mol:	-30.14
Dipole, Da:	2.11
IP(EA), eV:	-8.25(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-(chloromethyl)-6-(trifluoromethoxy)pyridin-3-ol

Drug info:

PubChemData

Smile

CCOC1=CC=CC2=C1SC(=C2OC)Br

DOS

IR

Vibrations