Geometry & MOs

Info

ID:	255742
PubChem CID:	103134413
Reduced:	ClSO5C13H15 (1)
Stoich.:	ABC5D13E15 (1)
Weight, g/mol:	320.04119
ΔH_f, kcal/mol:	-207.17
Dipole, Da:	2.89
IP(EA), eV:	-10.09(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1-bromonaphthalen-2-yl)oxymethyl]-5-methyloxolane

Drug info:

PubChemData

Smile

CC1CCC(O1)CS(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)O

DOS

IR

Vibrations