Geometry & MOs

Info

ID:	369564
PubChem CID:	127334619
Reduced:	ON4C18H28 (1)
Stoich.:	AB4C18D28 (1)
Weight, g/mol:	303.169525
ΔH_f, kcal/mol:	-34.69
Dipole, Da:	6.67
IP(EA), eV:	-8.87(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-oxo-N-(1-pyridazin-3-ylpiperidin-3-yl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)CC(=O)NC2CCCN(C2)C3=NN=CC=C3

DOS

IR

Vibrations