Geometry & MOs

Info

ID:	220489
PubChem CID:	85195554
Reduced:	OC7H13 (2)
Stoich.:	AB7C13 (2)
Weight, g/mol:	226.19328
ΔH_f, kcal/mol:	-109.27
Dipole, Da:	1.12
IP(EA), eV:	-9.9(1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methylpropyl)dec-4-enoic acid

Drug info:

PubChemData

Smile

CCCCCCC#CC(C(CCCC)O)O

DOS

IR

Vibrations