Geometry & MOs

Info

ID:	183679
PubChem CID:	77054868
Reduced:	N2O2C11H14 (1)
Stoich.:	A2B2C11D14 (1)
Weight, g/mol:	317.177313
ΔH_f, kcal/mol:	-28.79
Dipole, Da:	2.7
IP(EA), eV:	-8.67(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-2-methyl-4-[(4-oxo-6-propyl-1,3-diazinan-2-yl)sulfanyl]pentanoate

Drug info:

PubChemData

Smile

CCONC(=O)C1CC2=CC=CC=C2N1

DOS

IR

Vibrations