Geometry & MOs

Info

ID:	27633
PubChem CID:	822717
Reduced:	IN2O2H11C12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	311.071306
ΔH_f, kcal/mol:	-17.18
Dipole, Da:	3.95
IP(EA), eV:	-8.88(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-2-(2-chlorophenyl)-4-[(2,5-dimethylphenyl)methylidene]-1,3-oxazol-5-one

Drug info:

PubChemData

Smile

CC(=C1C(=O)NN(C1=O)C2=CC=C(C=C2)I)C

DOS

IR

Vibrations