Geometry & MOs

Info

ID:	256145
PubChem CID:	103137355
Reduced:	ClOC17H23 (1)
Stoich.:	ABC17D23 (1)
Weight, g/mol:	220.04628
ΔH_f, kcal/mol:	-70.44
Dipole, Da:	4.05
IP(EA), eV:	-9.35(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromobutyl)-5-methyloxolane

Drug info:

PubChemData

Smile

CC1CCC(O1)CC2CCCC3=CC=CC=C3C2Cl

DOS

IR

Vibrations