Geometry & MOs

Info

ID:	330256
PubChem CID:	127247243
Reduced:	O2N5C14H17 (1)
Stoich.:	A2B5C14D17 (1)
Weight, g/mol:	287.17461
ΔH_f, kcal/mol:	-17.4
Dipole, Da:	1.55
IP(EA), eV:	-9.71(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-ethyl-5-methylpyrazol-3-yl)-[2-(1H-pyrazol-5-yl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C1CCN(C(C1)C2=CC=NN2)C(=O)CN3C=CC=NC3=O

DOS

IR

Vibrations