Geometry & MOs

Info

ID:	372209
PubChem CID:	131294376
Reduced:	ISO3H9C11 (1)
Stoich.:	ABC3D9E11 (1)
Weight, g/mol:	232.045962
ΔH_f, kcal/mol:	-77.16
Dipole, Da:	2.83
IP(EA), eV:	-9.04(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[3-(trifluoromethyl)-1,2-oxazol-4-yl]methyl]furan-2-amine

Drug info:

PubChemData

Smile

COC(=O)C1=CC2=C(C=C1)C(=C(S2)CO)I

DOS

IR

Vibrations