Geometry & MOs

Info

ID:	144943
PubChem CID:	53435186
Reduced:	NOH4C5 (2)
Stoich.:	ABC4D5 (2)
Weight, g/mol:	204.070622
ΔH_f, kcal/mol:	20.61
Dipole, Da:	2.76
IP(EA), eV:	-9.85(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-methyl-4-(1,2,4-oxadiazol-3-yl)phenyl]boronic acid

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C=O)C2=NOC=N2

DOS

IR

Vibrations