Geometry & MOs

Info

ID:	381919
PubChem CID:	134972783
Reduced:	O4C19H28 (1)
Stoich.:	A4B19C28 (1)
Weight, g/mol:	348.16043
ΔH_f, kcal/mol:	-197.26
Dipole, Da:	1.67
IP(EA), eV:	-8.27(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (2R,6R)-4-[tert-butyl(dimethyl)silyl]oxy-2,6-dihydroxyhept-3-enedioate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C2=C1O[C@](CC2)(C)CCCC(=O)OC)C)OC)C

DOS

IR

Vibrations