Geometry & MOs

Info

ID:

140990

PubChem CID:

52796095

Reduced:

NO4C19H24 (1)

Stoich.:

AB4C19D24 (1)

Weight, g/mol:

434.289306

ΔHf, kcal/mol:

-91.41

Dipole, Da:

6.47

IP(EA), eV:

0.0(0.0)

Spin(Sz, S2):

0.500000, 1.012623

Charge, e:

0

Chem-info

IUPAC name:

N,N-diethyl-1-[2-[(5S,9S)-7,7,9-trimethyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]acetyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

C1C[C@@H](OC1)C[NH+](CC2=C3C(=CC=C2)OCCO3)CC4=CC=CO4

DOS

IR

Vibrations