Geometry & MOs

Info

ID:	392256
PubChem CID:	135013936
Reduced:	SiO5C22H40 (1)
Stoich.:	AB5C22D40 (1)
Weight, g/mol:	430.275066
ΔH_f, kcal/mol:	-300.25
Dipole, Da:	3.24
IP(EA), eV:	-8.73(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (1R)-4-[tert-butyl(dimethyl)silyl]oxy-7,8-dihydroxy-3,7-dimethyl-2-oxocyclononane-1-carboxylate

Drug info:

PubChemData

Smile

CC/1[C@H](CC[C@@]2([C@@H](O2)C/C(=C1/O)/C(=O)OC(C)(C)C)C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations