Geometry & MOs

Info

ID:	253277
PubChem CID:	103117327
Reduced:	O2N4C13H16 (1)
Stoich.:	A2B4C13D16 (1)
Weight, g/mol:	290.135446
ΔH_f, kcal/mol:	-19.22
Dipole, Da:	1.88
IP(EA), eV:	-9.05(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-piperidin-4-yl-N-(2,2,2-trifluoroethyl)pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1COC(CN1)CNC(=O)C2=C3C=CC=CN3N=C2

DOS

IR

Vibrations