Geometry & MOs

Info

ID:	295652
PubChem CID:	117541413
Reduced:	O2C7H10 (2)
Stoich.:	A2B7C10 (2)
Weight, g/mol:	279.98474
ΔH_f, kcal/mol:	-160.64
Dipole, Da:	3.56
IP(EA), eV:	-8.38(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-amino-5-(4-bromophenyl)-1,3-oxazol-4-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1OC)C(C(=O)C(C)C)O)OC

DOS

IR

Vibrations