Geometry & MOs

Info

ID:	54165
PubChem CID:	14735501
Reduced:	ClNO2C18H28 (1)
Stoich.:	ABC2D18E28 (1)
Weight, g/mol:	267.92853
ΔH_f, kcal/mol:	-111.56
Dipole, Da:	3.67
IP(EA), eV:	-10.41(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dibromo-5,6-dimethylspiro[2.3]hexane

Drug info:

PubChemData

Smile

CCCCCCCC[C@H]1C[C@]2(CC(=O)[C@@H]1C[C@]2(C#N)Cl)OC

DOS

IR

Vibrations