Geometry & MOs

Info

ID:	59259
PubChem CID:	24775846
Reduced:	N3O4C21H23 (1)
Stoich.:	A3B4C21D23 (1)
Weight, g/mol:	353.137556
ΔH_f, kcal/mol:	-72.41
Dipole, Da:	4.01
IP(EA), eV:	-8.56(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-(3-cyclopentyloxy-4-methoxyphenyl)pyrazolo[1,5-a]pyrimidine-2-carboxylic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=NN2C(=CC=NC2=C1)C3=CC(=C(C=C3)OC)OC4CCCC4

DOS

IR

Vibrations