Geometry & MOs

Info

ID:	132647
PubChem CID:	51392586
Reduced:	Cl3N5H10C16 (1)
Stoich.:	A3B5C10D16 (1)
Weight, g/mol:	342.106551
ΔH_f, kcal/mol:	134.35
Dipole, Da:	10.03
IP(EA), eV:	-10.08(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(4R)-4-(3-methylbutanoylamino)-5-oxo-1-phenyl-4-(trifluoromethyl)imidazol-2-olate

Drug info:

PubChemData

Smile

C1[C@H](N2C(=NN=N2)N=C1C3=CC=CC=C3Cl)C4=C(C=CC=C4Cl)Cl

DOS

IR

Vibrations