Geometry & MOs

Info

ID:	260996
PubChem CID:	103213455
Reduced:	ClINF2O3H5C11 (1)
Stoich.:	ABCD2E3F5G11 (1)
Weight, g/mol:	317.068649
ΔH_f, kcal/mol:	-143.71
Dipole, Da:	5.92
IP(EA), eV:	-10.03(-2.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(difluoromethyl)-2-[2-(2,2,2-trifluoroethoxy)ethyl]-1,3-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1C2=NC(=C(O2)C(=O)O)C(F)F)Cl)I

DOS

IR

Vibrations