Geometry & MOs

Info

ID:	205619
PubChem CID:	80127496
Reduced:	BrSF2N3C13H14 (1)
Stoich.:	ABC2D3E13F14 (1)
Weight, g/mol:	345.97646
ΔH_f, kcal/mol:	-31.01
Dipole, Da:	4.72
IP(EA), eV:	-9.32(-1.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-amino-2-(4-bromo-2,6-difluorophenyl)-1,3-oxazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)NCC1=NN=C(S1)C2=C(C=C(C=C2F)Br)F

DOS

IR

Vibrations