Geometry & MOs

Info

ID:	216382
PubChem CID:	85086133
Reduced:	FN3O5C9H14 (1)
Stoich.:	AB3C5D9E14 (1)
Weight, g/mol:	269.083413
ΔH_f, kcal/mol:	-236.28
Dipole, Da:	3.98
IP(EA), eV:	-10.39(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-thia-4,6,10-triazatricyclo[9.4.0.03,8]pentadecane-5,7,9-trione

Drug info:

PubChemData

Smile

C1C(C(OC1N2CC(C(=O)NC2=O)F)CON)O

DOS

IR

Vibrations