Geometry & MOs

Info

ID:	313370
PubChem CID:	126614135
Reduced:	OF3N3C14H18 (1)
Stoich.:	AB3C3D14E18 (1)
Weight, g/mol:	299.124547
ΔH_f, kcal/mol:	-145.05
Dipole, Da:	5.64
IP(EA), eV:	-8.64(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylbut-3-yn-2-yl)-2-(3,3,3-trifluoropropylamino)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C#C)C1(C(=CC=CN1)C(=O)N)NCCC(F)(F)F

DOS

IR

Vibrations