Geometry & MOs

Info

ID:	232913
PubChem CID:	87577608
Reduced:	SN2O5C10H24 (1)
Stoich.:	AB2C5D10E24 (1)
Weight, g/mol:	259.251129
ΔH_f, kcal/mol:	-244.58
Dipole, Da:	5.43
IP(EA), eV:	-9.47(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-pentyloctylamino)ethane-1,1-diol

Drug info:

PubChemData

Smile

CCCCCS(=O)(=O)CCOC(=O)O.C(CN)N

DOS

IR

Vibrations