Geometry & MOs

Info

ID:	40651
PubChem CID:	8144473
Reduced:	ClSO2N4C20H24 (1)
Stoich.:	ABC2D4E20F24 (1)
Weight, g/mol:	282.181767
ΔH_f, kcal/mol:	-32.85
Dipole, Da:	6.63
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.764021
Charge, e:	1

Chem-info

IUPAC name:

(5R,6R)-6-methyl-3-(morpholin-4-ium-4-ylmethyl)-1,3-diazaspiro[4.5]decane-2,4-dione

Drug info:

PubChemData

Smile

CC(C)(C)NC(=O)C[NH+](C)CC1=NC(=O)C2=C(N1)C=C(S2)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations