Geometry & MOs

Info

ID:	402064
PubChem CID:	135054127
Reduced:	SO4C14H16 (1)
Stoich.:	AB4C14D16 (1)
Weight, g/mol:	196.073559
ΔH_f, kcal/mol:	-141.72
Dipole, Da:	1.48
IP(EA), eV:	-9.06(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-[(R)-furan-2-yl(hydroxy)methyl]prop-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(C(=C)[C@@H](C[C@H]1C2=CC=CS2)O)O

DOS

IR

Vibrations