Geometry & MOs

Info

ID:	274669
PubChem CID:	103810945
Reduced:	SN2O3C10H20 (1)
Stoich.:	AB2C3D10E20 (1)
Weight, g/mol:	220.088164
ΔH_f, kcal/mol:	-141.36
Dipole, Da:	2.32
IP(EA), eV:	-9.8(0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C)(CN)C(=O)N1CCCS(=O)(=O)CC1

DOS

IR

Vibrations