Geometry & MOs

Info

ID:	292877
PubChem CID:	117362288
Reduced:	ON2C6H6 (2)
Stoich.:	AB2C6D6 (2)
Weight, g/mol:	244.096026
ΔH_f, kcal/mol:	-10.28
Dipole, Da:	3.35
IP(EA), eV:	-8.85(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(5-amino-1H-pyrazol-4-yl)phenyl]-1,2-oxazolidin-3-one

Drug info:

PubChemData

Smile

CCN1C2=C(C=CC(=C2)C3=CC(=NN3)N)OC1=O

DOS

IR

Vibrations