Geometry & MOs

Info

ID:	60164
PubChem CID:	26675811
Reduced:	NO3C10H10 (2)
Stoich.:	AB3C10D10 (2)
Weight, g/mol:	341.106336
ΔH_f, kcal/mol:	-106.57
Dipole, Da:	4.27
IP(EA), eV:	-8.64(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[[5-(4-fluorophenyl)-1,3-oxazol-2-yl]methoxy]-3-methoxyphenyl]ethanone

Drug info:

PubChemData

Smile

CC(=O)C1=CC(=C(C=C1)OCC2=NC(=NO2)C3=CC(=C(C=C3)OC)OC)OC

DOS

IR

Vibrations