Geometry & MOs

Info

ID:	281794
PubChem CID:	103914376
Reduced:	SN2O4C16H34 (1)
Stoich.:	AB2C4D16E34 (1)
Weight, g/mol:	324.252526
ΔH_f, kcal/mol:	-240.91
Dipole, Da:	3.16
IP(EA), eV:	-9.39(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[1-(1-methylimidazol-2-yl)ethylamino]hexyl]carbamate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations