Geometry & MOs

Info

ID:	359014
PubChem CID:	127297258
Reduced:	ON3C8H13 (2)
Stoich.:	AB3C8D13 (2)
Weight, g/mol:	383.232125
ΔH_f, kcal/mol:	-39.57
Dipole, Da:	4.8
IP(EA), eV:	-8.79(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylpiperazin-1-yl)-2-[1-(1H-indazole-7-carbonyl)piperidin-4-yl]ethanone

Drug info:

PubChemData

Smile

CCN1CCN(CC1)C(=O)CC2CCN(CC2)C(=O)C3=NNN=C3

DOS

IR

Vibrations