Geometry & MOs

Info

ID:	315251
PubChem CID:	126625275
Reduced:	F2O2N5C21H25 (1)
Stoich.:	A2B2C5D21E25 (1)
Weight, g/mol:	235.076392
ΔH_f, kcal/mol:	-118.7
Dipole, Da:	0.83
IP(EA), eV:	-9.17(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(4-chlorophenyl)-5-methyl-4-propan-2-yl-1,2-oxazole

Drug info:

PubChemData

Smile

C1COC[C@@H]1N=C(NC(CC(C2=CC=C(C=C2)F)N)N)NC(=O)C3=CC=C(C=C3)F

DOS

IR

Vibrations