Geometry & MOs

Info

ID:	228151
PubChem CID:	87563533
Reduced:	OSC7H14 (2)
Stoich.:	ABC7D14 (2)
Weight, g/mol:	218.145285
ΔH_f, kcal/mol:	-144.12
Dipole, Da:	4.84
IP(EA), eV:	-8.79(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-[tert-butyl(methyl)amino]ethyl-methylamino]ethanethioic S-acid

Drug info:

PubChemData

Smile

CCCSCCC(CCCCC(=O)O)SCCC

DOS

IR

Vibrations