Geometry & MOs

Info

ID:	287384
PubChem CID:	104239700
Reduced:	ClO2N4C13H13 (1)
Stoich.:	AB2C4D13E13 (1)
Weight, g/mol:	250.077599
ΔH_f, kcal/mol:	-6.17
Dipole, Da:	5.2
IP(EA), eV:	-9.98(-1.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-cyclopentyl-1-methylthieno[2,3-c]pyrazole-5-carboxylic acid

Drug info:

PubChemData

Smile

C1CCC(C1)C2=NN(C(=C2C(=O)O)Cl)C3=NC=CN=C3

DOS

IR

Vibrations