Geometry & MOs

Info

ID:	394518
PubChem CID:	135023133
Reduced:	N2O5C9H16 (1)
Stoich.:	A2B5C9D16 (1)
Weight, g/mol:	244.109944
ΔH_f, kcal/mol:	-145.06
Dipole, Da:	1.56
IP(EA), eV:	-10.48(-1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-(4-ethoxyphenyl)-3-prop-2-enylfuran-2-one

Drug info:

PubChemData

Smile

CC1(N=N1)C[C@H]2C(C([C@@H](C(O2)CO)O)O)O

DOS

IR

Vibrations