Geometry & MOs

Info

ID:	419049
PubChem CID:	135107387
Reduced:	FNO3C18H26 (1)
Stoich.:	ABC3D18E26 (1)
Weight, g/mol:	382.189257
ΔH_f, kcal/mol:	-196.68
Dipole, Da:	0.91
IP(EA), eV:	-9.4(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(6-methoxyspiro[3,4-dihydroisochromene-1,4'-piperidine]-1'-carbonyl)-1,6-dimethylpyridin-2-one

Drug info:

PubChemData

Smile

CC(C)(CC1=CC=C(C=C1)F)NC(=O)[C@@H]2CC[C@@H]([C@@H](C2)OC)O

DOS

IR

Vibrations