Geometry & MOs

Info

ID:	260659
PubChem CID:	103199239
Reduced:	NSF2O5C12H15 (1)
Stoich.:	ABC2D5E12F15 (1)
Weight, g/mol:	378.94224
ΔH_f, kcal/mol:	-283.56
Dipole, Da:	9.03
IP(EA), eV:	-10.38(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(4-bromo-3-chlorophenyl)-4-(difluoromethyl)-1,3-oxazole-5-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N=C(O1)C2CCCCS2(=O)=O)C(F)F

DOS

IR

Vibrations