Geometry & MOs

Info

ID:	419152
PubChem CID:	135107611
Reduced:	FN3O4C19H24 (1)
Stoich.:	AB3C4D19E24 (1)
Weight, g/mol:	352.178693
ΔH_f, kcal/mol:	-148.91
Dipole, Da:	4.13
IP(EA), eV:	-8.9(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-yl)-(5-methylpyridin-3-yl)methanone

Drug info:

PubChemData

Smile

CN(C)C1=NOC(=C1C(=O)N[C@@H]2CCCC[C@H]2O)C3=CC(=C(C=C3)F)OC

DOS

IR

Vibrations