Geometry & MOs

Info

ID:	57358
PubChem CID:	22395740
Reduced:	OC8H12 (1)
Stoich.:	AB8C12 (1)
Weight, g/mol:	256.24023
ΔH_f, kcal/mol:	-25.59
Dipole, Da:	2.41
IP(EA), eV:	-9.65(0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-butyldodecanoic acid

Drug info:

PubChemData

Smile

C1C=C(C2CC1C2)CO

DOS

IR

Vibrations