Geometry & MOs

Info

ID:	220350
PubChem CID:	85177323
Reduced:	OCl2C12H16 (1)
Stoich.:	AB2C12D16 (1)
Weight, g/mol:	249.112484
ΔH_f, kcal/mol:	-81.41
Dipole, Da:	5.04
IP(EA), eV:	-10.11(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-amino-1-(2-hydroxyethoxy)propyl]-5-fluoro-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

C1CCC2(C3CCC(=O)C3C2(CC1)Cl)Cl

DOS

IR

Vibrations