Geometry & MOs

Info

ID:	272996
PubChem CID:	103769998
Reduced:	SF2N2O3C9H14 (1)
Stoich.:	AB2C2D3E9F14 (1)
Weight, g/mol:	250.032062
ΔH_f, kcal/mol:	-242.91
Dipole, Da:	3.79
IP(EA), eV:	-9.51(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(3,3-difluoro-2-hydroxypropyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

C1CSC(=O)N1CCC(=O)NCC(C(F)F)O

DOS

IR

Vibrations