Geometry & MOs

Info

ID:	408072
PubChem CID:	135080827
Reduced:	O3C12H16 (1)
Stoich.:	A3B12C16 (1)
Weight, g/mol:	234.064057
ΔH_f, kcal/mol:	-90.79
Dipole, Da:	2.19
IP(EA), eV:	-9.36(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methoxy-1-methyl-2H-[1]benzofuro[2,3-c]pyrazole-6,7-diol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COCCCOCC=O

DOS

IR

Vibrations