Geometry & MOs

Info

ID:	272079
PubChem CID:	103723343
Reduced:	NF3O3C14H18 (1)
Stoich.:	AB3C3D14E18 (1)
Weight, g/mol:	250.056527
ΔH_f, kcal/mol:	-284.15
Dipole, Da:	4.46
IP(EA), eV:	-9.2(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-oxo-N-(3,3,3-trifluoro-2-hydroxypropyl)-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC=C1)OCC(=O)NCC(C(F)(F)F)O

DOS

IR

Vibrations