Geometry & MOs

Info

ID:	352463
PubChem CID:	127283551
Reduced:	S2N3O4C12H17 (1)
Stoich.:	A2B3C4D12E17 (1)
Weight, g/mol:	345.081698
ΔH_f, kcal/mol:	-94.95
Dipole, Da:	3.77
IP(EA), eV:	-8.93(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-(1-oxo-1,4-thiazinan-4-yl)ethyl]sulfanylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)CSCC(=O)N2CCS(=O)CC2

DOS

IR

Vibrations