Geometry & MOs

Info

ID:	407983
PubChem CID:	135080738
Reduced:	ClOC10H11 (1)
Stoich.:	ABC10D11 (1)
Weight, g/mol:	160.073559
ΔH_f, kcal/mol:	-29.83
Dipole, Da:	1.33
IP(EA), eV:	-9.47(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-4-methoxy-2-(methoxymethyl)but-2-enoic acid

Drug info:

PubChemData

Smile

C/C=C(/CO)\C1=CC=C(C=C1)Cl

DOS

IR

Vibrations