Geometry & MOs

Info

ID:	29295
PubChem CID:	832854
Reduced:	NS2O3H11C17 (1)
Stoich.:	AB2C3D11E17 (1)
Weight, g/mol:	292.121178
ΔH_f, kcal/mol:	-12.86
Dipole, Da:	4.52
IP(EA), eV:	-8.54(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4E)-4-[[4-(dimethylamino)phenyl]methylidene]-3-phenyl-1,2-oxazol-5-one

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)N2C(=CSC2=S)OC(=O)C3=CC=CC=C3

DOS

IR

Vibrations