Geometry & MOs

Info

ID:	294651
PubChem CID:	117478800
Reduced:	FSN3O3C12H12 (1)
Stoich.:	ABC3D3E12F12 (1)
Weight, g/mol:	297.172879
ΔH_f, kcal/mol:	-82.75
Dipole, Da:	6.89
IP(EA), eV:	-9.41(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(2,6,8-trimethylfuro[2,3-f][1]benzofuran-4-yl)cyclopentyl]methanamine

Drug info:

PubChemData

Smile

C1C(CO1)S(=O)(=O)C2=C(C=C(C=C2)C3=C(NN=C3)N)F

DOS

IR

Vibrations