Geometry & MOs

Info

ID:	19875
PubChem CID:	574489
Reduced:	ON2C5H8 (1)
Stoich.:	AB2C5D8 (1)
Weight, g/mol:	112.063663
ΔH_f, kcal/mol:	-13.67
Dipole, Da:	6.2
IP(EA), eV:	-9.11(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dimethyl-1H-pyrazol-5-one

Drug info:

PubChemData

Smile

CC1=CC(=O)NN1C

DOS

IR

Vibrations