Geometry & MOs

Info

ID:	184344
PubChem CID:	77148812
Reduced:	FOC10H10 (2)
Stoich.:	ABC10D10 (2)
Weight, g/mol:	294.085186
ΔH_f, kcal/mol:	-118.1
Dipole, Da:	5.94
IP(EA), eV:	-8.87(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(hydroxymethyl)-5-(6-nitro-1H-indol-2-yl)oxolane-3,4-diol

Drug info:

PubChemData

Smile

C1CC1C#CC2=CC3=C(CC4(C3)CCC(CC4=O)OC(F)F)C=C2

DOS

IR

Vibrations