Geometry & MOs

Info

ID:	361956
PubChem CID:	127304952
Reduced:	SO2N3C18H33 (1)
Stoich.:	AB2C3D18E33 (1)
Weight, g/mol:	318.241962
ΔH_f, kcal/mol:	-119.47
Dipole, Da:	6.68
IP(EA), eV:	-8.76(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(3-ethylpiperidin-1-yl)-2-methylpropyl]-1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CCC1CCCN(C1)C(C)(C)CNC(=O)C2CSCN2C(=O)CC

DOS

IR

Vibrations