Geometry & MOs

Info

ID:	274670
PubChem CID:	103810946
Reduced:	SN2O3C8H16 (1)
Stoich.:	AB2C3D8E16 (1)
Weight, g/mol:	234.103814
ΔH_f, kcal/mol:	-130.45
Dipole, Da:	7.61
IP(EA), eV:	-9.81(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,1-dioxo-1,4-thiazepan-4-yl)-2-(ethylamino)ethanone

Drug info:

PubChemData

Smile

CNCC(=O)N1CCCS(=O)(=O)CC1

DOS

IR

Vibrations