Geometry & MOs

Info

ID:	218886
PubChem CID:	85090116
Reduced:	SO2N4H9C11 (2)
Stoich.:	AB2C4D9E11 (2)
Weight, g/mol:	522.153236
ΔH_f, kcal/mol:	76.77
Dipole, Da:	1.59
IP(EA), eV:	-9.37(-1.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[tert-butyl(diphenyl)silyl]oxymethyl]-4-hydroxy-3-phenoxycarbothioyloxyoxolan-2-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=NN=C3N2N=C(S3)C(C(C(C(C4=NN5C(=NN=C5S4)C6=CC=CC=C6)O)O)O)O

DOS

IR

Vibrations