Geometry & MOs

Info

ID:	205035
PubChem CID:	80047575
Reduced:	O3C17H32 (1)
Stoich.:	A3B17C32 (1)
Weight, g/mol:	216.172545
ΔH_f, kcal/mol:	-204.72
Dipole, Da:	6.25
IP(EA), eV:	-10.41(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-butyl-3-hydroxyoctanoic acid

Drug info:

PubChemData

Smile

CCCCC(C(=O)O)C1(CCC(CC1)C(C)(C)CC)O

DOS

IR

Vibrations