Geometry & MOs

Info

ID:	286213
PubChem CID:	104162175
Reduced:	ClNSO2C14H16 (1)
Stoich.:	ABCD2E14F16 (1)
Weight, g/mol:	217.077265
ΔH_f, kcal/mol:	-87.99
Dipole, Da:	3.85
IP(EA), eV:	-9.55(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-hydroxy-3-methylbutyl)-1,3-thiazinane-2,4-dione

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=O)N(C(=O)S2)CCCCCCCl

DOS

IR

Vibrations