Geometry & MOs

Info

ID:	301135
PubChem CID:	123060011
Reduced:	FN2O4C31H31 (1)
Stoich.:	AB2C4D31E31 (1)
Weight, g/mol:	513.251523
ΔH_f, kcal/mol:	-129.49
Dipole, Da:	5.36
IP(EA), eV:	-7.78(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-4-[hydroxy-(3-propan-2-yloxyphenyl)methylidene]-5-(4-propan-2-ylphenyl)-1-(3-propoxyphenyl)pyrrolidine-2,3-dione

Drug info:

PubChemData

Smile

CC(C)OC1=CC=CC(=C1)/C(=C\2/C(N(C(=O)C2=O)C3=CC=C(C=C3)N4CCCCC4)C5=CC=C(C=C5)F)/O

DOS

IR

Vibrations