Geometry & MOs

Info

ID:	144346
PubChem CID:	53353157
Reduced:	FNPS2O11C24H31 (1)
Stoich.:	ABCD2E11F24G31 (1)
Weight, g/mol:	527.242021
ΔH_f, kcal/mol:	-567.19
Dipole, Da:	0.99
IP(EA), eV:	-8.91(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[7-[[4-[[ethyl(2-phenoxyethyl)amino]methyl]phenyl]methoxy]-3-oxo-1H-isoindol-2-yl]piperidine-2,6-dione

Drug info:

PubChemData

Smile

CC(C)OP(=O)(OC(C)C)OC(COC1=CC=C(C=C1)CC2C(=O)NC(=O)S2)C3=CC=CC=C3F.OS(=O)(=O)O

DOS

IR

Vibrations