Geometry & MOs

Info

ID:	253606
PubChem CID:	103119530
Reduced:	ON4C14H14 (1)
Stoich.:	AB4C14D14 (1)
Weight, g/mol:	274.062139
ΔH_f, kcal/mol:	81.33
Dipole, Da:	3.31
IP(EA), eV:	-8.7(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-chlorophenyl)-3-(1-methylpyrazol-3-yl)-1,2-oxazol-5-amine

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=C(ON=C2C3=NN(C=C3)C)N

DOS

IR

Vibrations