Geometry & MOs

Info

ID:	393465
PubChem CID:	135020643
Reduced:	O5C19H26 (1)
Stoich.:	A5B19C26 (1)
Weight, g/mol:	460.267642
ΔH_f, kcal/mol:	-187.1
Dipole, Da:	3.44
IP(EA), eV:	-9.53(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (4R,5R)-4,6-bis[[tert-butyl(dimethyl)silyl]oxy]-3-oxo-5-prop-2-enoxyhexanoate

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OC[C@H]1[C@@H](COC(O1)C2=CC=CC=C2)OCC=C

DOS

IR

Vibrations