Geometry & MOs

Info

ID:	414711
PubChem CID:	135087670
Reduced:	SO2N5C17H27 (1)
Stoich.:	AB2C5D17E27 (1)
Weight, g/mol:	367.214744
ΔH_f, kcal/mol:	-51.81
Dipole, Da:	2.72
IP(EA), eV:	-8.56(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(8-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-[(1S,2R,4S,5R)-3-tricyclo[3.2.1.02,4]octanyl]methanone

Drug info:

PubChemData

Smile

CN(C)C1=NC=C2CCC3(C2=N1)CCCN(C3)S(=O)(=O)N4CCCC4

DOS

IR

Vibrations