Geometry & MOs

Info

ID:	386894
PubChem CID:	134983283
Reduced:	O3C20H26 (1)
Stoich.:	A3B20C26 (1)
Weight, g/mol:	486.283292
ΔH_f, kcal/mol:	-52.5
Dipole, Da:	2.17
IP(EA), eV:	-9.03(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[(3S,4S,4aS,6R,8aS)-3,4-bis[[tert-butyl(dimethyl)silyl]oxy]-2-methylidene-4,4a,6,7,8,8a-hexahydro-3H-pyrano[3,2-b]pyran-6-yl]acetate

Drug info:

PubChemData

Smile

CO[C@@]1(CC/C=C\C[C@@H]([C@H](O1)C=C)OCC2=CC=CC=C2)C=C

DOS

IR

Vibrations