Geometry & MOs

Info

ID:	359355
PubChem CID:	127298407
Reduced:	SO2N7C17H29 (1)
Stoich.:	AB2C7D17E29 (1)
Weight, g/mol:	373.21139
ΔH_f, kcal/mol:	-26.06
Dipole, Da:	10.05
IP(EA), eV:	-8.92(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[4-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidine-1-carbonyl]pyridine-2-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C(=O)CC2CCN(CC2)C(=O)CCSC3=NN=NN3C

DOS

IR

Vibrations