Geometry & MOs

Info

ID:	168141
PubChem CID:	74928972
Reduced:	FSO5H23C26 (1)
Stoich.:	ABC5D23E26 (1)
Weight, g/mol:	330.173213
ΔH_f, kcal/mol:	-191.73
Dipole, Da:	1.04
IP(EA), eV:	-8.47(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(6-methylpyridin-2-yl)oxy-1-phenylethyl]-1,3-dihydroisoindole

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)SCC2C(C(C(O2)F)OC(=O)C3=CC=CC=C3)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations