Geometry & MOs

Info

ID:	124171
PubChem CID:	50873913
Reduced:	NO6H11C12 (1)
Stoich.:	AB6C11D12 (1)
Weight, g/mol:	292.105922
ΔH_f, kcal/mol:	-235.32
Dipole, Da:	9.6
IP(EA), eV:	-9.72(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 1-(2-methyl-3-nitrophenyl)-5-oxopyrrolidine-3-carboxylate

Drug info:

PubChemData

Smile

C1C(CN(C1=O)C2=CC(=C(C=C2)C(=O)O)O)C(=O)O

DOS

IR

Vibrations