Geometry & MOs

Info

ID:	399643
PubChem CID:	135041419
Reduced:	NO3C13H21 (1)
Stoich.:	AB3C13D21 (1)
Weight, g/mol:	212.104859
ΔH_f, kcal/mol:	-164.46
Dipole, Da:	3.28
IP(EA), eV:	-9.27(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (5R)-5-but-3-enyl-2-oxooxolane-3-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1CCCCC1N2CCCC2=O

DOS

IR

Vibrations