Geometry & MOs

Info

ID:	221972
PubChem CID:	85293078
Reduced:	SO4C24H40 (1)
Stoich.:	AB4C24D40 (1)
Weight, g/mol:	426.204239
ΔH_f, kcal/mol:	-234.37
Dipole, Da:	1.3
IP(EA), eV:	-8.35(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[6-methoxy-2-methyl-4,5-bis(phenylmethoxy)oxan-3-yl] but-2-enoate

Drug info:

PubChemData

Smile

CC(C(C)SC1=CC(=C(C(=C1)C(C)(C)C)O)C(C)(C)C)OCC(=O)OC(C)(C)C

DOS

IR

Vibrations