Geometry & MOs

Info

ID:	344664
PubChem CID:	127268252
Reduced:	O3N4C17H28 (1)
Stoich.:	A3B4C17D28 (1)
Weight, g/mol:	247.124215
ΔH_f, kcal/mol:	-94.9
Dipole, Da:	4.09
IP(EA), eV:	-9.23(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(oxan-2-ylmethylsulfonyl)piperidine

Drug info:

PubChemData

Smile

CCCC(=O)NC1CCCN(C1)CC2=NOC(=N2)C3CCOCC3

DOS

IR

Vibrations