Geometry & MOs

Info

ID:	40429
PubChem CID:	8144105
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	357.229051
ΔH_f, kcal/mol:	-69.41
Dipole, Da:	3.41
IP(EA), eV:	-8.37(0.09)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C[C@H]1CCCC[C@@]12C(=O)N(C(=O)N2)CN3CCN(CC3)C4=CC=CC=C4

DOS

IR

Vibrations