Geometry & MOs

Info

ID:	159276
PubChem CID:	57269405
Reduced:	NCl2F3O4H12C16 (1)
Stoich.:	AB2C3D4E12F16 (1)
Weight, g/mol:	305.177964
ΔH_f, kcal/mol:	-292.98
Dipole, Da:	3.45
IP(EA), eV:	-10.05(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-ethyl-3-[(3-methyl-4,5,6,7-tetrahydro-1H-inden-2-yl)methylidene]-1H-indol-2-one

Drug info:

PubChemData

Smile

CC1=NC(=C(C(C1C(=O)O)C2=C(C(=CC=C2)Cl)Cl)C(=O)OC)C(F)(F)F

DOS

IR

Vibrations