Geometry & MOs

Info

ID:	361812
PubChem CID:	127304718
Reduced:	SN2O4C15H26 (1)
Stoich.:	AB2C4D15E26 (1)
Weight, g/mol:	344.176979
ΔH_f, kcal/mol:	-209.34
Dipole, Da:	4.08
IP(EA), eV:	-9.65(0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(1,1-dioxo-1,4-thiazepane-4-carbonyl)piperidin-1-yl]-2-methylbutan-1-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCS(=O)(=O)CC1)NC(=O)C2CCCCC2

DOS

IR

Vibrations