Geometry & MOs

Info

ID:	420142
PubChem CID:	135111387
Reduced:	NO2C13H25 (1)
Stoich.:	AB2C13D25 (1)
Weight, g/mol:	329.173942
ΔH_f, kcal/mol:	-117.68
Dipole, Da:	0.82
IP(EA), eV:	-8.58(2.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-hydroxy-1-spiro[4,9-dihydro-3H-pyrano[3,4-b]indole-1,4'-piperidine]-1'-ylpropan-1-one

Drug info:

PubChemData

Smile

COCCCN1CCC[C@@]2(C1)CCC[C@H]2O

DOS

IR

Vibrations