Geometry & MOs

Info

ID:

414352

PubChem CID:

135087308

Reduced:

SO4N8C36H50 (1)

Stoich.:

AB4C8D36E50 (1)

Weight, g/mol:

381.205242

ΔHf, kcal/mol:

-110.61

Dipole, Da:

8.34

IP(EA), eV:

 -9.29(-0.76)

Spin(Sz, S2):

 None, None

Charge, e:

 0

Chem-info

IUPAC name:

1-(2-oxo-2-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylethyl)piperidin-2-one

Drug info:

PubChemData

Smile

CC1=NN2CC(=O)N[C@H](CN(CC(=O)N[C@H](C3=NC(=CS3)C(=O)N[C@H](C2=N1)CC4=CC=CC=C4)CC(C)C)C(=O)CCC5(CC5)C)C(C)C

DOS

IR

Vibrations