Geometry & MOs

Info

ID:	231663
PubChem CID:	87574408
Reduced:	SbC16H36 (1)
Stoich.:	AB16C36 (1)
Weight, g/mol:	427.80813
ΔH_f, kcal/mol:	-10.85
Dipole, Da:	1.21
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.782815
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-2-(dibromomethylidene)-4-phenoxybutanoic acid

Drug info:

PubChemData

Smile

CCCC[Sb](CCCC)(CCCC)CCCC

DOS

IR

Vibrations