Geometry & MOs

Info

ID:	247776
PubChem CID:	103073212
Reduced:	NOSC10H19 (1)
Stoich.:	ABCD10E19 (1)
Weight, g/mol:	187.103085
ΔH_f, kcal/mol:	-45.5
Dipole, Da:	1.57
IP(EA), eV:	-8.9(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC(=C)CS

DOS

IR

Vibrations