Geometry & MOs

Info

ID:	392237
PubChem CID:	135013814
Reduced:	SiO4C22H40 (1)
Stoich.:	AB4C22D40 (1)
Weight, g/mol:	408.07976
ΔH_f, kcal/mol:	-281.64
Dipole, Da:	2.42
IP(EA), eV:	-8.76(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (1R,2R,4S,7S)-2-iodo-1,6-dimethyl-5-oxo-10-oxabicyclo[5.2.1]decane-4-carboxylate

Drug info:

PubChemData

Smile

CC1C(CC/C(=C\C[C@@H](C1=O)C(=O)OC(C)(C)C)/C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations