Geometry & MOs

Info

ID:	430472
PubChem CID:	135170536
Reduced:	N2F3H11C12 (1)
Stoich.:	A2B3C11D12 (1)
Weight, g/mol:	209.105193
ΔH_f, kcal/mol:	-105.54
Dipole, Da:	6.65
IP(EA), eV:	-9.31(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-ethyl-1-methyl-5-oxo-2H-pyrrol-2-yl) cyclopropanecarboxylate

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C(F)(F)F)C2=CC=CC=C2

DOS

IR

Vibrations