Geometry & MOs

Info

ID:	411636
PubChem CID:	135084468
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	236.141244
ΔH_f, kcal/mol:	-110.55
Dipole, Da:	4.99
IP(EA), eV:	-9.78(0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl (2E)-2-[(2E)-penta-2,4-dienoxy]hexa-2,5-dienoate

Drug info:

PubChemData

Smile

CC(C)(C)/C=C\CCCC(=O)O

DOS

IR

Vibrations