Geometry & MOs

Info

ID:	24059
PubChem CID:	607625
Reduced:	ClOBr2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	411.96272
ΔH_f, kcal/mol:	-71.14
Dipole, Da:	5.75
IP(EA), eV:	-10.19(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,10-dibromo-9-chloro-1,5,5,9-tetramethylspiro[5.5]undec-1-en-3-one

Drug info:

PubChemData

Smile

CC1=CC(=O)C(C(C12CCC(C(C2)Br)(C)Cl)(C)C)Br

DOS

IR

Vibrations