Geometry & MOs

Info

ID:	40833
PubChem CID:	8144786
Reduced:	O2N3C22H32 (1)
Stoich.:	A2B3C22D32 (1)
Weight, g/mol:	369.241627
ΔH_f, kcal/mol:	-73.18
Dipole, Da:	2.78
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.757533
Charge, e:	0

Chem-info

IUPAC name:

(5S,6S)-3-[(4-benzylpiperidin-1-yl)methyl]-6-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)C[NH+]3CCC(CC3)CC4=CC=CC=C4

DOS

IR

Vibrations