Geometry & MOs

Info

ID:	347254
PubChem CID:	127271795
Reduced:	ON4C22H36 (1)
Stoich.:	AB4C22D36 (1)
Weight, g/mol:	346.273262
ΔH_f, kcal/mol:	-52.29
Dipole, Da:	4.43
IP(EA), eV:	-8.72(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclohexyl-1-methyl-N-[(1-propan-2-ylpiperidin-3-yl)methyl]pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)C2CCCCC2)C(=O)NC3CCN(CC3)CC4CCCC4

DOS

IR

Vibrations