Geometry & MOs

Info

ID:	289902
PubChem CID:	104385285
Reduced:	ON5C12H19 (1)
Stoich.:	AB5C12D19 (1)
Weight, g/mol:	231.104148
ΔH_f, kcal/mol:	4.69
Dipole, Da:	3.02
IP(EA), eV:	-9.09(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-[2-(diethylamino)-2-oxoethyl]-3-sulfanylidenepropanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC1=C(C(=NN1C)C)C#N

DOS

IR

Vibrations