Geometry & MOs

Info

ID:	390809
PubChem CID:	135001061
Reduced:	O3C8H14 (1)
Stoich.:	A3B8C14 (1)
Weight, g/mol:	342.11371
ΔH_f, kcal/mol:	-67.8
Dipole, Da:	1.69
IP(EA), eV:	-9.97(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl 2-[(S)-[(6S)-6-methyloxan-2-yl]oxy-thiophen-2-ylmethyl]propanedioate

Drug info:

PubChemData

Smile

CC(=O)C[C@@H](CCC=C)OO

DOS

IR

Vibrations