Geometry & MOs

Info

ID:	267523
PubChem CID:	103582562
Reduced:	BrClO2N3H9C10 (1)
Stoich.:	ABC2D3E9F10 (1)
Weight, g/mol:	293.97707
ΔH_f, kcal/mol:	-52.88
Dipole, Da:	0.71
IP(EA), eV:	-9.17(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(5-bromo-3-chloropyridin-2-yl)amino]-2-methylpropane-1,2-diol

Drug info:

PubChemData

Smile

CN1C(=O)CC(C1=O)NC2=C(C=C(C=N2)Br)Cl

DOS

IR

Vibrations