Geometry & MOs

Info

ID:	45334
PubChem CID:	10511418
Reduced:	O2C4H7 (2)
Stoich.:	A2B4C7 (2)
Weight, g/mol:	174.019605
ΔH_f, kcal/mol:	-184.48
Dipole, Da:	1.43
IP(EA), eV:	-10.15(0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-chloro-1-methylpyrazole-4-carboxylate

Drug info:

PubChemData

Smile

C1[C@@H](COC1O)[C@H](CC=O)CO

DOS

IR

Vibrations