Geometry & MOs

Info

ID:	197356
PubChem CID:	78955746
Reduced:	F3N3O3C8H10 (1)
Stoich.:	A3B3C3D8E10 (1)
Weight, g/mol:	259.14331
ΔH_f, kcal/mol:	-227.89
Dipole, Da:	5.54
IP(EA), eV:	-10.67(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-6-(2-pyrazol-1-ylethylamino)pyridine-3-carboxamide

Drug info:

PubChemData

Smile

COC(=O)C1=NN(C=N1)CCOCC(F)(F)F

DOS

IR

Vibrations