Geometry & MOs

Info

ID:	399418
PubChem CID:	135040174
Reduced:	O2C7H11 (2)
Stoich.:	A2B7C11 (2)
Weight, g/mol:	214.120509
ΔH_f, kcal/mol:	-168.07
Dipole, Da:	5.0
IP(EA), eV:	-8.71(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dimethyl (E)-3-methyloct-2-enedioate

Drug info:

PubChemData

Smile

C[C@@H](C[C@@H](CO)O)COCC1=CC=C(C=C1)OC

DOS

IR

Vibrations