Geometry & MOs

Info

ID:	370334
PubChem CID:	127338106
Reduced:	SN3O4C18H33 (1)
Stoich.:	AB3C4D18E33 (1)
Weight, g/mol:	374.198777
ΔH_f, kcal/mol:	-208.61
Dipole, Da:	7.72
IP(EA), eV:	-9.19(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[1-(oxan-4-ylsulfonyl)piperidin-4-yl]piperazine-1-carboxamide

Drug info:

PubChemData

Smile

CCN(C1CCCC1)C(=O)NC2CCN(CC2)S(=O)(=O)C3CCOCC3

DOS

IR

Vibrations