Geometry & MOs

Info

ID:	388724
PubChem CID:	134989995
Reduced:	NOC5H5 (2)
Stoich.:	ABC5D5 (2)
Weight, g/mol:	207.075625
ΔH_f, kcal/mol:	75.52
Dipole, Da:	5.24
IP(EA), eV:	-9.8(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5E)-5-(5-methyl-1,2,4-oxadiazol-3-ylidene)imidazol-4-yl]acetamide

Drug info:

PubChemData

Smile

C1C=CC2C1[C@H]3C[C@@H]2C4=[N+](ON=C34)[O-]

DOS

IR

Vibrations