Geometry & MOs

Info

ID:	330310
PubChem CID:	127247297
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	287.17461
ΔH_f, kcal/mol:	17.01
Dipole, Da:	4.84
IP(EA), eV:	-9.48(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylpyrazol-1-yl)-1-[2-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CCN1C=C(C=N1)C(=O)N2CCCCC2C3=C(C=NN3)C

DOS

IR

Vibrations