Geometry & MOs

Info

ID:	59258
PubChem CID:	24775845
Reduced:	O2N3C24H29 (1)
Stoich.:	A2B3C24D29 (1)
Weight, g/mol:	381.168856
ΔH_f, kcal/mol:	-12.3
Dipole, Da:	3.68
IP(EA), eV:	-8.49(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C2=CC=NC3=CC(=NN23)C4CCCCC4)OC5CCCC5

DOS

IR

Vibrations