Geometry & MOs

Info

ID:	266992
PubChem CID:	103580332
Reduced:	BrClSN2O2C10H14 (1)
Stoich.:	ABCD2E2F10G14 (1)
Weight, g/mol:	305.97707
ΔH_f, kcal/mol:	-72.94
Dipole, Da:	3.71
IP(EA), eV:	-9.09(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(5-bromo-3-chloropyridin-2-yl)morpholin-2-yl]methanol

Drug info:

PubChemData

Smile

CC(C)(CNC1=C(C=C(C=N1)Br)Cl)S(=O)(=O)C

DOS

IR

Vibrations