Geometry & MOs

Info

ID:	58904
PubChem CID:	24715267
Reduced:	OF2N2H16C17 (1)
Stoich.:	AB2C2D16E17 (1)
Weight, g/mol:	333.091355
ΔH_f, kcal/mol:	-43.9
Dipole, Da:	4.26
IP(EA), eV:	-9.17(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2-fluorophenyl)-2-phenylpyrazolo[1,5-a]pyrimidine-7-carboxylic acid

Drug info:

PubChemData

Smile

C1C(ON=C1C2=CC=C(C=C2)F)CNCC3=CC=C(C=C3)F

DOS

IR

Vibrations