Geometry & MOs

Info

ID:	226990
PubChem CID:	87559449
Reduced:	NSC11H25 (1)
Stoich.:	ABC11D25 (1)
Weight, g/mol:	329.06742
ΔH_f, kcal/mol:	-47.81
Dipole, Da:	3.82
IP(EA), eV:	-8.89(0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

11-amino-1-iodoundecane-1-thiol

Drug info:

PubChemData

Smile

CC(CCCCCCCCS)CN

DOS

IR

Vibrations