Geometry & MOs

Info

ID:	358885
PubChem CID:	127296756
Reduced:	O2N3C20H27 (1)
Stoich.:	A2B3C20D27 (1)
Weight, g/mol:	374.27941
ΔH_f, kcal/mol:	-73.78
Dipole, Da:	6.08
IP(EA), eV:	-8.33(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(1-methylpiperidin-2-yl)methyl]-N-(1-methyl-4,5,6,7-tetrahydroindazol-4-yl)piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1CCCO1)NC(=O)N2CCCCC2C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations