Geometry & MOs

Info

ID:	372169
PubChem CID:	131294077
Reduced:	ON4H8C10 (1)
Stoich.:	AB4C8D10 (1)
Weight, g/mol:	200.058578
ΔH_f, kcal/mol:	74.08
Dipole, Da:	7.52
IP(EA), eV:	-9.49(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3-hydroxy-2-methylphenyl)-1,2-oxazole-3-carbonitrile

Drug info:

PubChemData

Smile

C1=CC=NC(=C1)CN2C=C(C(=N2)C#N)O

DOS

IR

Vibrations