Geometry & MOs

Info

ID:	217885
PubChem CID:	85088533
Reduced:	OC14H20 (2)
Stoich.:	AB14C20 (2)
Weight, g/mol:	408.179057
ΔH_f, kcal/mol:	-105.05
Dipole, Da:	3.72
IP(EA), eV:	-8.81(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-(benzenesulfonyl)-2,4-dimethyl-8-oxabicyclo[5.1.0]oct-5-en-3-yl]oxy-tert-butyl-dimethylsilane

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1C)OC(CC2=O)(C)CCC=C(C)CCC=C(C)CCC=C(C)C

DOS

IR

Vibrations