Geometry & MOs

Info

ID:	29876
PubChem CID:	837947
Reduced:	O5C17H18 (1)
Stoich.:	A5B17C18 (1)
Weight, g/mol:	284.043321
ΔH_f, kcal/mol:	-149.03
Dipole, Da:	5.81
IP(EA), eV:	-8.48(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4Z)-2-(furan-2-yl)-4-[(3-nitrophenyl)methylidene]-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

CC1=CC=CC=C1OC(=O)C2=CC(=C(C=C2OC)OC)OC

DOS

IR

Vibrations