Geometry & MOs

Info

ID:	337988
PubChem CID:	127258611
Reduced:	OC6H11 (2)
Stoich.:	AB6C11 (2)
Weight, g/mol:	174.125594
ΔH_f, kcal/mol:	-119.25
Dipole, Da:	1.73
IP(EA), eV:	-9.67(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-hydroxy-2-methylbutyl) butanoate

Drug info:

PubChemData

Smile

CCCC(=O)OCC(CC)/C=C/CC

DOS

IR

Vibrations