Geometry & MOs

Info

ID:	194193
PubChem CID:	78497030
Reduced:	SN3O4C12H21 (1)
Stoich.:	AB3C4D12E21 (1)
Weight, g/mol:	307.135448
ΔH_f, kcal/mol:	-194.91
Dipole, Da:	5.3
IP(EA), eV:	-9.03(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-2-[(4-ethyl-6-oxo-1,3-diazinan-2-yl)sulfanyl]acetamide

Drug info:

PubChemData

Smile

CCC1CC(=O)NC(N1)SCC(=O)NCC(=O)OCC

DOS

IR

Vibrations