Geometry & MOs

Info

ID:	357630
PubChem CID:	127294303
Reduced:	ON7C20H31 (1)
Stoich.:	AB7C20D31 (1)
Weight, g/mol:	341.221561
ΔH_f, kcal/mol:	15.63
Dipole, Da:	4.45
IP(EA), eV:	-8.62(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-indazol-7-yl-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=CC(=NC2=NC(=NN12)CC(=O)N3CCN(CC3)CC4CCCCN4C)C

DOS

IR

Vibrations