Geometry & MOs

Info

ID:	242538
PubChem CID:	97301905
Reduced:	ClN2S2H5C6 (1)
Stoich.:	AB2C2D5E6 (1)
Weight, g/mol:	216.126263
ΔH_f, kcal/mol:	54.6
Dipole, Da:	3.09
IP(EA), eV:	-9.08(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-amino-3-(naphthalen-2-ylamino)propan-2-ol

Drug info:

PubChemData

Smile

C1=CC(=C(N=C1)Cl)NC(=S)S

DOS

IR

Vibrations