Geometry & MOs

Info

ID:	247797
PubChem CID:	103073287
Reduced:	NSC11H21 (1)
Stoich.:	ABC11D21 (1)
Weight, g/mol:	201.118735
ΔH_f, kcal/mol:	-6.62
Dipole, Da:	1.77
IP(EA), eV:	-8.55(0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-ethylmorpholin-4-yl)methyl]prop-2-ene-1-thiol

Drug info:

PubChemData

Smile

CCN(CC(=C)CS)C1CCCC1

DOS

IR

Vibrations