Geometry & MOs

Info

ID:	231541
PubChem CID:	87574073
Reduced:	FSN2O3H9C10 (1)
Stoich.:	ABC2D3E9F10 (1)
Weight, g/mol:	246.089209
ΔH_f, kcal/mol:	-88.57
Dipole, Da:	2.72
IP(EA), eV:	-9.66(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclopentyl-5,7-dihydroxychromen-2-one

Drug info:

PubChemData

Smile

CS(=O)(=O)NC1=C(C=C(C=C1F)C(=O)N)C#C

DOS

IR

Vibrations