Geometry & MOs

Info

ID:	189582
PubChem CID:	77875926
Reduced:	Cl2O4N5H11C13 (1)
Stoich.:	A2B4C5D11E13 (1)
Weight, g/mol:	287.173273
ΔH_f, kcal/mol:	-94.4
Dipole, Da:	4.49
IP(EA), eV:	-9.61(-1.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propyl 3-hexoxy-2-hydroxy-5-oxopyrrolidine-2-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1Cl)C2=NC(N(C(=N2)N)C(=CC(=O)O)C(=O)O)N)Cl

DOS

IR

Vibrations