Geometry & MOs

Info

ID:	386821
PubChem CID:	134983050
Reduced:	SSi2C24H42 (1)
Stoich.:	AB2C24D42 (1)
Weight, g/mol:	281.162708
ΔH_f, kcal/mol:	-74.78
Dipole, Da:	3.16
IP(EA), eV:	-8.11(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1S,2S,4R,5R)-2-ethyl-4-methyl-3-oxo-8-oxabicyclo[3.2.1]oct-6-en-1-yl]carbamate

Drug info:

PubChemData

Smile

CC/C/1=C(/C(=C(\C2=C(/C(=C1/CC)/[Si](C)(C)C)CSC2)/[Si](C)(C)C)/CC)\CC

DOS

IR

Vibrations