Geometry & MOs

Info

ID:	370525
PubChem CID:	127339538
Reduced:	NSO3C14H25 (1)
Stoich.:	ABC3D14E25 (1)
Weight, g/mol:	219.092915
ΔH_f, kcal/mol:	-167.59
Dipole, Da:	4.86
IP(EA), eV:	-10.01(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-methyl-1,1-dioxo-1,4-thiazinan-4-yl)butan-1-one

Drug info:

PubChemData

Smile

CC1CCC(CC1)CC(=O)N2CCS(=O)(=O)C(C2)C

DOS

IR

Vibrations