Geometry & MOs

Info

ID:	330249
PubChem CID:	127247236
Reduced:	ON4C14H18 (1)
Stoich.:	AB4C14D18 (1)
Weight, g/mol:	259.14331
ΔH_f, kcal/mol:	13.07
Dipole, Da:	3.22
IP(EA), eV:	-9.2(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-imidazol-1-yl-1-[2-(1H-pyrazol-5-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CN1C=CC=C1C(=O)N2CCCCC2C3=CC=NN3

DOS

IR

Vibrations