Geometry & MOs

Info

ID:	45475
PubChem CID:	10513984
Reduced:	O3C14H20 (1)
Stoich.:	A3B14C20 (1)
Weight, g/mol:	236.17763
ΔH_f, kcal/mol:	-103.13
Dipole, Da:	3.62
IP(EA), eV:	-9.59(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (2Z,6R,8E,10E)-6-methyldodeca-2,8,10-trienoate

Drug info:

PubChemData

Smile

CC(COCC1=CC=CC=C1)C(C(=C)CO)O

DOS

IR

Vibrations