Geometry & MOs

Info

ID:	224631
PubChem CID:	85345434
Reduced:	SO3C16H22 (1)
Stoich.:	AB3C16D22 (1)
Weight, g/mol:	295.24713
ΔH_f, kcal/mol:	-117.27
Dipole, Da:	4.82
IP(EA), eV:	-10.11(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

spiro[8-azonia-7-boranuidatetracyclo[9.2.1.02,10.03,8]tetradeca-3(8),12-diene-7,9'-9-boranuidabicyclo[3.3.1]nonane]

Drug info:

PubChemData

Smile

C1CCCC2(C(CC1)CC2S(=O)(=O)C3=CC=CC=C3)O

DOS

IR

Vibrations