Geometry & MOs

Info

ID:	298458
PubChem CID:	117649952
Reduced:	N2S2C15H20 (1)
Stoich.:	A2B2C15D20 (1)
Weight, g/mol:	278.064651
ΔH_f, kcal/mol:	73.33
Dipole, Da:	2.21
IP(EA), eV:	-8.02(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methylsulfanylpropanoyloxy)prop-2-enyl 3-methylsulfanylpropanoate

Drug info:

PubChemData

Smile

CSC1C=CC=CN1CC(=C)N2C=CC=CC2SC

DOS

IR

Vibrations