Geometry & MOs

Info

ID:	247799
PubChem CID:	103073292
Reduced:	SN2C11H22 (1)
Stoich.:	AB2C11D22 (1)
Weight, g/mol:	208.10342
ΔH_f, kcal/mol:	4.9
Dipole, Da:	4.64
IP(EA), eV:	-8.6(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[methyl(pyridin-2-ylmethyl)amino]methyl]prop-2-ene-1-thiol

Drug info:

PubChemData

Smile

CN(C)C1CCN(CC1)CC(=C)CS

DOS

IR

Vibrations