Geometry & MOs

Info

ID:	57614
PubChem CID:	22426150
Reduced:	FN3O4H12C19 (1)
Stoich.:	AB3C4D12E19 (1)
Weight, g/mol:	365.081184
ΔH_f, kcal/mol:	-51.21
Dipole, Da:	3.72
IP(EA), eV:	-7.9(-1.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[4-(dihydroxymethylidene)-3-(4-fluorophenyl)-1,2-dihydropyrazolo[3,4-b]pyridin-6-yl]cyclohexa-3,5-diene-1,2-dione

Drug info:

PubChemData

Smile

C1=CC(=O)C(=O)C(=C1)C2=CC(=C(O)O)C3=C(NNC3=N2)C4=CC=C(C=C4)F

DOS

IR

Vibrations