Geometry & MOs

Info

ID:	375591
PubChem CID:	134214038
Reduced:	SF2N2C12H20 (1)
Stoich.:	AB2C2D12E20 (1)
Weight, g/mol:	205.006119
ΔH_f, kcal/mol:	-97.95
Dipole, Da:	6.62
IP(EA), eV:	-8.75(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-2-(5,6-dichloropyridin-3-yl)propan-1-ol

Drug info:

PubChemData

Smile

CCCCC(C)(C)C1=CC(=NN1C)SC(F)F

DOS

IR

Vibrations