Geometry & MOs

Info

ID:	292878
PubChem CID:	117362317
Reduced:	ON2C6H6 (2)
Stoich.:	AB2C6D6 (2)
Weight, g/mol:	244.096026
ΔH_f, kcal/mol:	20.57
Dipole, Da:	2.2
IP(EA), eV:	-8.68(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CON(C1=O)C2=CC=CC(=C2)C3=C(NN=C3)N

DOS

IR

Vibrations