Geometry & MOs

Info

ID:	217933
PubChem CID:	85088607
Reduced:	S2O5C20H28 (1)
Stoich.:	A2B5C20D28 (1)
Weight, g/mol:	412.173972
ΔH_f, kcal/mol:	-135.14
Dipole, Da:	15.86
IP(EA), eV:	-7.31(-2.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(benzenesulfonyl)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]oxiran-2-yl]cyclopentan-1-ol

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(=O)C23S(=O)C4(S3(=O)=O)C5CCC(C4=O)(C5(C)C)C)C)C

DOS

IR

Vibrations