Geometry & MOs

Info

ID:	40955
PubChem CID:	8145015
Reduced:	N3O4C18H30 (1)
Stoich.:	A3B4C18D30 (1)
Weight, g/mol:	351.215806
ΔH_f, kcal/mol:	-185.28
Dipole, Da:	4.22
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 0.757426
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-[[(5S,6R)-6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl]methyl]piperidine-4-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1CC[NH+](CC1)CN2C(=O)[C@@]3(CCCC[C@H]3C)NC2=O

DOS

IR

Vibrations