Geometry & MOs

Info

ID:	356758
PubChem CID:	127292298
Reduced:	ON5C22H31 (1)
Stoich.:	AB5C22D31 (1)
Weight, g/mol:	328.201159
ΔH_f, kcal/mol:	-14.08
Dipole, Da:	5.77
IP(EA), eV:	-9.05(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1H-imidazol-2-yl)-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)(CNC(=O)N1CCCCC1C2=NC=CN2)N3CCC4=CC=CC=C4C3

DOS

IR

Vibrations