Geometry & MOs

Info

ID:

312751

PubChem CID:

126607816

Reduced:

IOH25C37 (1)

Stoich.:

ABC25D37 (1)

Weight, g/mol:

533.290625

ΔHf, kcal/mol:

229.97

Dipole, Da:

2.69

IP(EA), eV:

 -8.76(-1.25)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

2-[6-(cyclohexa-1,3-dien-1-ylmethoxy)spiro[2H-1-benzofuran-3,4'-piperidine]-1'-yl]ethyl bis(2-methylpropyl) phosphate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC(=C(C=C2)C(C3=C(C=C(C=C3)C4=C=C=CC=C4)C5=CC=CC=C5)(O)I)C6=CC=CC=C6

DOS

IR

Vibrations