Geometry & MOs

Info

ID:	145470
PubChem CID:	53530200
Reduced:	O3N4C15H22 (1)
Stoich.:	A3B4C15D22 (1)
Weight, g/mol:	381.216475
ΔH_f, kcal/mol:	-96.19
Dipole, Da:	2.97
IP(EA), eV:	-9.37(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(1-benzyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-1,4-dicarboxamide

Drug info:

PubChemData

Smile

CC(C(=O)N(C)C)NC(=O)C1=C(N=CC=C1)N2CCOCC2

DOS

IR

Vibrations