Geometry & MOs

Info

ID:	393345
PubChem CID:	135020212
Reduced:	O6C17H24 (1)
Stoich.:	A6B17C24 (1)
Weight, g/mol:	356.183503
ΔH_f, kcal/mol:	-242.26
Dipole, Da:	3.6
IP(EA), eV:	-9.85(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-[(2R)-3-[(4S)-2,2-dimethyl-1,3-dioxolan-4-yl]-2-hydroxy-1-methoxy-2-methylpropyl]-2-methylfuran-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C/C#C[C@@](C)(C[C@H]1COC(O1)(C)C)O)/C(=O)C

DOS

IR

Vibrations