Geometry & MOs

Info

ID:	423770
PubChem CID:	135120177
Reduced:	N5O6C28H29 (1)
Stoich.:	A5B6C28D29 (1)
Weight, g/mol:	303.158292
ΔH_f, kcal/mol:	-137.84
Dipole, Da:	6.83
IP(EA), eV:	-9.23(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4R,5S)-7-[[3-(furan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]-7-azaspiro[4.5]decan-4-ol

Drug info:

PubChemData

Smile

COC1=C2C=C(C=C1)C(=O)N[C@H]3CN(C[C@@H]3OC4=CC=C(CNC(=O)CO2)C=C4)C(=O)C5=NNC6=C5CCC6

DOS

IR

Vibrations