Geometry & MOs

Info

ID:	358827
PubChem CID:	127296695
Reduced:	ClSN2O3C15H19 (1)
Stoich.:	ABC2D3E15F19 (1)
Weight, g/mol:	394.156243
ΔH_f, kcal/mol:	-101.05
Dipole, Da:	6.92
IP(EA), eV:	-9.58(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-3-methyl-1-(4-methylidenepiperidin-1-yl)-1-oxobutan-2-yl]-2,3-dihydro-1,4-benzodioxine-6-sulfonamide

Drug info:

PubChemData

Smile

C=C1CCN(CC1)C(=O)CCNS(=O)(=O)C2=CC(=CC=C2)Cl

DOS

IR

Vibrations