Geometry & MOs

Info

ID:	216106
PubChem CID:	85085741
Reduced:	O3C13H24 (1)
Stoich.:	A3B13C24 (1)
Weight, g/mol:	228.01498
ΔH_f, kcal/mol:	-150.89
Dipole, Da:	1.73
IP(EA), eV:	-9.78(1.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-bromopropyl)bicyclo[3.2.0]hept-2-en-6-one

Drug info:

PubChemData

Smile

CC1(C2CCC1(C(C2OCCOC)O)C)C

DOS

IR

Vibrations