Geometry & MOs

Info

ID:	231688
PubChem CID:	87574450
Reduced:	O2C15H29 (2)
Stoich.:	A2B15C29 (2)
Weight, g/mol:	347.080299
ΔH_f, kcal/mol:	-292.12
Dipole, Da:	3.71
IP(EA), eV:	-9.96(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,2,2-trifluoroacetyl) 1-(2-pyridin-2-ylethyl)-2-sulfanylcyclopentane-1-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCC(=O)C(CO)(C(=O)CCCCCCCCCCCCC)O

DOS

IR

Vibrations