Geometry & MOs

Info

ID:	48338
PubChem CID:	10539012
Reduced:	SO2N4C10H16 (1)
Stoich.:	AB2C4D10E16 (1)
Weight, g/mol:	256.178693
ΔH_f, kcal/mol:	-60.7
Dipole, Da:	7.68
IP(EA), eV:	-8.73(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl (2S)-2-tert-butyl-4-oxo-1,3-diazinane-1-carboxylate

Drug info:

PubChemData

Smile

CCCCCC(=O)N1C(=C(C(=S)N1)C(=O)N)N

DOS

IR

Vibrations