Geometry & MOs

Info

ID:	251255
PubChem CID:	103102487
Reduced:	SN3O3C8H15 (1)
Stoich.:	AB3C3D8E15 (1)
Weight, g/mol:	295.099063
ΔH_f, kcal/mol:	-111.29
Dipole, Da:	4.55
IP(EA), eV:	-10.03(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[2-(4-carbamothioylphenoxy)acetyl]-ethylamino]acetamide

Drug info:

PubChemData

Smile

CCC(C#N)S(=O)(=O)N(CC)CC(=O)N

DOS

IR

Vibrations