Geometry & MOs

Info

ID:	256957
PubChem CID:	103142700
Reduced:	NOC13H15 (1)
Stoich.:	ABC13D15 (1)
Weight, g/mol:	316.02296
ΔH_f, kcal/mol:	-15.62
Dipole, Da:	1.35
IP(EA), eV:	-9.12(-0.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-bromo-2-(4-chlorophenyl)propyl]-5-methyloxolane

Drug info:

PubChemData

Smile

CCC(C)(C1=CC=CC2=C1C=NC=C2)O

DOS

IR

Vibrations