Geometry & MOs

Info

ID:	10866
PubChem CID:	108585
Reduced:	N2O6H26C33 (1)
Stoich.:	A2B6C26D33 (1)
Weight, g/mol:	546.179087
ΔH_f, kcal/mol:	-114.38
Dipole, Da:	4.65
IP(EA), eV:	-9.35(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[4-[2-[4-(2-methyl-1,3-dioxoisoindol-4-yl)oxyphenyl]propan-2-yl]phenoxy]isoindole-1,3-dione

Drug info:

PubChemData

Smile

CC(C)(C1=CC=C(C=C1)OC2=CC=CC3=C2C(=O)N(C3=O)C)C4=CC=C(C=C4)OC5=CC=CC6=C5C(=O)N(C6=O)C

DOS

IR

Vibrations