Geometry & MOs

Info

ID:	281481
PubChem CID:	103913932
Reduced:	SN2O4C15H32 (1)
Stoich.:	AB2C4D15E32 (1)
Weight, g/mol:	249.209264
ΔH_f, kcal/mol:	-236.77
Dipole, Da:	5.03
IP(EA), eV:	-9.3(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-(3,5-dimethylphenyl)ethylamino]hexan-1-ol

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)OC(C)(C)C)NC(C)CS(=O)(=O)C

DOS

IR

Vibrations