Geometry & MOs

Info

ID:	370818
PubChem CID:	127340647
Reduced:	ON2C14H24 (1)
Stoich.:	AB2C14D24 (1)
Weight, g/mol:	257.119798
ΔH_f, kcal/mol:	-40.55
Dipole, Da:	4.3
IP(EA), eV:	-8.82(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(3-methylthiomorpholin-4-yl)-2-oxoethyl]-1,3-diazinan-2-one

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCCN(CC2)C(=O)C3CC3

DOS

IR

Vibrations