Geometry & MOs

Info

ID:	433819
PubChem CID:	135173962
Reduced:	SO5C13H22 (1)
Stoich.:	AB5C13D22 (1)
Weight, g/mol:	233.199094
ΔH_f, kcal/mol:	-249.15
Dipole, Da:	5.28
IP(EA), eV:	-10.69(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-methoxybutoxy)-1-(methylamino)hexan-1-ol

Drug info:

PubChemData

Smile

CC1CC2CCCC(C1)(C2)C(=O)OCCS(=O)(=O)O

DOS

IR

Vibrations