Geometry & MOs

Info

ID:	313876
PubChem CID:	126618373
Reduced:	FN3O4C27H30 (1)
Stoich.:	AB3C4D27E30 (1)
Weight, g/mol:	329.081184
ΔH_f, kcal/mol:	-169.49
Dipole, Da:	7.23
IP(EA), eV:	-8.62(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-acetyl-5-(5-fluoropyrimidin-2-yl)oxyindol-1-yl]acetic acid

Drug info:

PubChemData

Smile

CC(=O)C1=CN(C2=C1C=C(C=C2)O)CC(=O)N3C[C@@H](C[C@H]3C(=O)NCCCCC4=CC=CC=C4)F

DOS

IR

Vibrations