Geometry & MOs

Info

ID:	355459
PubChem CID:	127288522
Reduced:	O2N4C19H28 (1)
Stoich.:	A2B4C19D28 (1)
Weight, g/mol:	329.210327
ΔH_f, kcal/mol:	-73.49
Dipole, Da:	6.05
IP(EA), eV:	-9.22(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[3-(4-methylpyrazol-1-yl)piperidine-1-carbonyl]bicyclo[3.3.1]nonan-9-one

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)C3CC(=O)N(C3)C4CCCC4

DOS

IR

Vibrations