Geometry & MOs

Info

ID:	272297
PubChem CID:	103738206
Reduced:	NO2C16H31 (1)
Stoich.:	AB2C16D31 (1)
Weight, g/mol:	248.077262
ΔH_f, kcal/mol:	-148.81
Dipole, Da:	2.55
IP(EA), eV:	-9.81(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-(3,3,3-trifluoro-2-hydroxypropyl)pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CCCC(CCO)CNC(=O)CC1CCCCCC1

DOS

IR

Vibrations