Geometry & MOs

Info

ID:	366093
PubChem CID:	127319439
Reduced:	S2N3O3C15H17 (1)
Stoich.:	A2B3C3D15E17 (1)
Weight, g/mol:	375.092263
ΔH_f, kcal/mol:	-74.77
Dipole, Da:	8.37
IP(EA), eV:	-9.42(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[(1,1-dioxothian-3-yl)amino]-2-oxoethyl]sulfanyl-N-(5-methyl-1,2-oxazol-3-yl)propanamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CC2=CSC(=N2)C3=CC=CC=N3

DOS

IR

Vibrations