Geometry & MOs

Info

ID:

420738

PubChem CID:

135114743

Reduced:

O4N7C36H49 (1)

Stoich.:

A4B7C36D49 (1)

Weight, g/mol:

408.204907

ΔHf, kcal/mol:

-125.78

Dipole, Da:

9.68

IP(EA), eV:

 -9.09(-0.27)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

4-(spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-carbonyl)-1-oxaspiro[4.4]nonan-2-one

Drug info:

PubChemData

Smile

C[C@@H]1C(=O)NCCCCN(CC2=CC=C(C=C2)C(=O)N[C@@H](C(=O)N[C@H](C(=O)N1)CC(C)C)CC3=CC=CC=C3)CC4=C(N(N=C4)C)C

DOS

IR

Vibrations