Geometry & MOs

Info

ID:	23671
PubChem CID:	605360
Reduced:	NOC5H5 (2)
Stoich.:	ABC5D5 (2)
Weight, g/mol:	190.074228
ΔH_f, kcal/mol:	-19.05
Dipole, Da:	7.9
IP(EA), eV:	-9.08(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-methoxyphenyl)-1,2-dihydropyrazol-3-one

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=CC(=O)NN2

DOS

IR

Vibrations