Geometry & MOs

Info

ID:	191644
PubChem CID:	78172797
Reduced:	FN2O5C25H33 (1)
Stoich.:	AB2C5D25E33 (1)
Weight, g/mol:	371.161184
ΔH_f, kcal/mol:	-156.65
Dipole, Da:	2.47
IP(EA), eV:	-8.74(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[[2-hydroxy-3-(2-methylphenoxy)propyl]amino]ethyl]-5-methyl-1,3-diazinane-2,4-dione;hydrochloride

Drug info:

PubChemData

Smile

C1CC2C(CC1OCCCN3CCC(CC3)C4C5=C(C=C(C=C5)F)ON4)OC=C(C2=O)CO

DOS

IR

Vibrations