Geometry & MOs

Info

ID:	367628
PubChem CID:	127325118
Reduced:	ON4C17H22 (1)
Stoich.:	AB4C17D22 (1)
Weight, g/mol:	370.211724
ΔH_f, kcal/mol:	2.65
Dipole, Da:	5.63
IP(EA), eV:	-9.13(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2-(1-methylpyrazol-4-yl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)-6-oxopiperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(CC(=O)NC1CCCC2=C1C=NN2C)C3=CN=CC=C3

DOS

IR

Vibrations