Geometry & MOs

Info

ID:	11817
PubChem CID:	121466
Reduced:	SCl2N3C12H21 (1)
Stoich.:	AB2C3D12E21 (1)
Weight, g/mol:	309.083324
ΔH_f, kcal/mol:	-37.54
Dipole, Da:	7.01
IP(EA), eV:	-9.08(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(1S,2S)-2-(dimethylamino)-1-phenylpropyl] carbamimidothioate;dihydrochloride

Drug info:

PubChemData

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C[C@@H]([C@H](C1=CC=CC=C1)SC(=N)N)N(C)C.Cl.Cl

DOS

IR

Vibrations