Geometry & MOs

Info

ID:	384496
PubChem CID:	134977092
Reduced:	H4C5 (4)
Stoich.:	A4B5 (4)
Weight, g/mol:	486.985456
ΔH_f, kcal/mol:	292.96
Dipole, Da:	0.06
IP(EA), eV:	-9.29(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3',7'-ditert-butyl-4,5,6,7-tetrachlorospiro[1,3,2lambda5-benzodioxaphosphole-2,1'-2,8-dioxa-5-aza-1lambda5-phosphabicyclo[3.3.0]octa-3,6-diene]

Drug info:

PubChemData

Smile

C1CC12C#CC#CC3(CC3)C4(CC4)C#CC#CC25CC5

DOS

IR

Vibrations