Geometry & MOs

Info

ID:	368549
PubChem CID:	127329417
Reduced:	SN2O4C12H22 (1)
Stoich.:	AB2C4D12E22 (1)
Weight, g/mol:	380.278741
ΔH_f, kcal/mol:	-189.45
Dipole, Da:	8.84
IP(EA), eV:	-9.49(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-N-[1-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]piperidin-4-yl]-2-(oxan-4-yl)acetamide

Drug info:

PubChemData

Smile

C1CN(S(=O)(=O)C1)CCNC(=O)CC2CCOCC2

DOS

IR

Vibrations