Geometry & MOs

Info

ID:	251258
PubChem CID:	103102513
Reduced:	SO2N4C11H14 (1)
Stoich.:	AB2C4D11E14 (1)
Weight, g/mol:	217.088498
ΔH_f, kcal/mol:	-40.81
Dipole, Da:	4.38
IP(EA), eV:	-9.2(-1.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(2-amino-2-oxoethyl)-N-ethyl-2-methyl-3-sulfanylidenepropanamide

Drug info:

PubChemData

Smile

CCN(CC(=O)N)C(=O)C1=NC=C(C=C1)C(=S)N

DOS

IR

Vibrations