Geometry & MOs

Info

ID:	45346
PubChem CID:	10511696
Reduced:	O3C10H16 (1)
Stoich.:	A3B10C16 (1)
Weight, g/mol:	184.109944
ΔH_f, kcal/mol:	-138.8
Dipole, Da:	2.46
IP(EA), eV:	-9.82(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (E)-7-hydroxy-2-methylidenehept-4-enoate

Drug info:

PubChemData

Smile

C1CC(C2(C1)OCCO2)CCC=O

DOS

IR

Vibrations