Geometry & MOs

Info

ID:	405294
PubChem CID:	135073351
Reduced:	ClO4H9C13 (1)
Stoich.:	AB4C9D13 (1)
Weight, g/mol:	296.02733
ΔH_f, kcal/mol:	-111.41
Dipole, Da:	3.98
IP(EA), eV:	-9.66(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-iodo-2-(3-methylbut-2-enoxy)oxane

Drug info:

PubChemData

Smile

COC(=O)/C=C/C1=COC2=C(C1=O)C=C(C=C2)Cl

DOS

IR

Vibrations