Geometry & MOs

Info

ID:	57369
PubChem CID:	22395762
Reduced:	OC14H18 (1)
Stoich.:	AB14C18 (1)
Weight, g/mol:	188.141244
ΔH_f, kcal/mol:	-33.37
Dipole, Da:	1.05
IP(EA), eV:	-8.84(0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-butoxy-2-ethylbutanoic acid

Drug info:

PubChemData

Smile

CC1CC(C=C(O1)C)(C)C2=CC=CC=C2

DOS

IR

Vibrations