Geometry & MOs

Info

ID:	433740
PubChem CID:	135173881
Reduced:	OSC11H16 (1)
Stoich.:	ABC11D16 (1)
Weight, g/mol:	816.182532
ΔH_f, kcal/mol:	-32.69
Dipole, Da:	2.26
IP(EA), eV:	-8.18(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[5-[4-[2-[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxyethoxy]phenyl]-1H-pyrrolo[2,3-b]pyridine-3-carbonyl]-2,4-difluorophenyl]-3-fluoropyrrolidine-1-sulfonamide

Drug info:

PubChemData

Smile

CC(C)CCCC1C=CC(=C=O)S1

DOS

IR

Vibrations