Geometry & MOs

Info

ID:	295471
PubChem CID:	117530184
Reduced:	ClO4C11H11 (1)
Stoich.:	AB4C11D11 (1)
Weight, g/mol:	245.072179
ΔH_f, kcal/mol:	-134.14
Dipole, Da:	6.63
IP(EA), eV:	-9.56(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,1-dioxo-1,4-thiazinan-4-yl)-2-(furan-2-yl)ethanol

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)Cl)C2(COC2)C(=O)O

DOS

IR

Vibrations