Geometry & MOs

Info

ID:	57370
PubChem CID:	22395763
Reduced:	O3C10H20 (1)
Stoich.:	A3B10C20 (1)
Weight, g/mol:	196.14633
ΔH_f, kcal/mol:	-168.85
Dipole, Da:	5.93
IP(EA), eV:	-10.4(0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohex-2-en-1-yl-2-methylpentanoic acid

Drug info:

PubChemData

Smile

CCCCOCCC(CC)C(=O)O

DOS

IR

Vibrations