Geometry & MOs

Info

ID:	221947
PubChem CID:	85292934
Reduced:	SN2O2C24H28 (1)
Stoich.:	AB2C2D24E28 (1)
Weight, g/mol:	408.175686
ΔH_f, kcal/mol:	-44.96
Dipole, Da:	5.94
IP(EA), eV:	-8.51(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[tert-butyl(diphenyl)silyl]oxymethyl]-3-hydroxy-3,3a,4,6a-tetrahydrocyclopenta[b]furan-2-one

Drug info:

PubChemData

Smile

CC1C(N(C(=O)N1C)C(=O)C(CC=C(C)C)SC2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations