Geometry & MOs

Info

ID:	3586
PubChem CID:	9822
Reduced:	N2O2C5H6 (1)
Stoich.:	A2B2C5D6 (1)
Weight, g/mol:	126.042927
ΔH_f, kcal/mol:	-50.42
Dipole, Da:	7.59
IP(EA), eV:	-10.3(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-1H-pyrazole-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C(=O)O

DOS

IR

Vibrations