Geometry & MOs

Info

ID:	56871
PubChem CID:	22394593
Reduced:	NOH4C6 (2)
Stoich.:	ABC4D6 (2)
Weight, g/mol:	289.085127
ΔH_f, kcal/mol:	28.24
Dipole, Da:	2.29
IP(EA), eV:	-9.07(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(E)-(4-phenyl-1,2,5-oxadiazol-3-ylidene)methyl]indol-2-one

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)/C(=C\C3=CON=C3)/C(=O)N2

DOS

IR

Vibrations