Geometry & MOs

Info

ID:	382335
PubChem CID:	134973420
Reduced:	SeO6C25H26 (1)
Stoich.:	AB6C25D26 (1)
Weight, g/mol:	460.19173
ΔH_f, kcal/mol:	-170.78
Dipole, Da:	2.81
IP(EA), eV:	-8.5(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R,3R,4S,6S)-4-[tert-butyl(dimethyl)silyl]oxy-2-formyl-6-(furan-2-yl)-6-methoxyoxan-3-yl] benzoate

Drug info:

PubChemData

Smile

C[C@@H](C1[C@H]([C@H](C[C@](O1)(C2=CC=CO2)OC)O)OC(=O)C3=CC=CC=C3)[Se]C4=CC=CC=C4

DOS

IR

Vibrations