Geometry & MOs

Info

ID:	53092
PubChem CID:	14709548
Reduced:	O5C10H16 (1)
Stoich.:	A5B10C16 (1)
Weight, g/mol:	264.099774
ΔH_f, kcal/mol:	-223.61
Dipole, Da:	2.09
IP(EA), eV:	-10.74(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxy-2-oxo-1-phenylethyl) 3-hydroxy-2-methylidenebutanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C)OC(=O)C(=C)C(C)O

DOS

IR

Vibrations