Geometry & MOs

Info

ID:	293331
PubChem CID:	117384754
Reduced:	ClN2O2C12H13 (1)
Stoich.:	AB2C2D12E13 (1)
Weight, g/mol:	252.066555
ΔH_f, kcal/mol:	-18.78
Dipole, Da:	2.59
IP(EA), eV:	-8.69(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-chloro-5-ethyl-4-methoxyphenyl)-1,2-oxazol-3-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1Cl)C)OC)C2=C(ON=C2)N

DOS

IR

Vibrations