Geometry & MOs

Info

ID:	324375
PubChem CID:	126677539
Reduced:	OC8H13 (2)
Stoich.:	AB8C13 (2)
Weight, g/mol:	384.184921
ΔH_f, kcal/mol:	-99.73
Dipole, Da:	2.2
IP(EA), eV:	-9.26(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[[(2R,3S,4R)-4-(3-fluoro-5-methoxyphenyl)-2-methylpiperidin-3-yl]methoxy]-2,3-dihydroisoindol-1-one

Drug info:

PubChemData

Smile

CC(C)(CC(C)(C)COCC1=CC=CC=C1)CO

DOS

IR

Vibrations