Geometry & MOs

Info

ID:	405018
PubChem CID:	135072134
Reduced:	SiO2C23H36 (1)
Stoich.:	AB2C23D36 (1)
Weight, g/mol:	356.147118
ΔH_f, kcal/mol:	-115.35
Dipole, Da:	1.35
IP(EA), eV:	-8.77(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-O-but-3-enyl 2-O-prop-2-ynyl 5,6-dimethoxy-5,6-dimethyl-1,4-dioxane-2,3-dicarboxylate

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)O[C@@H](CC=C)C1(CC=CC1)COCC2=CC=CC=C2

DOS

IR

Vibrations