Geometry & MOs

Info

ID:	8082
PubChem CID:	74901
Reduced:	OC5H10 (2)
Stoich.:	AB5C10 (2)
Weight, g/mol:	172.14633
ΔH_f, kcal/mol:	-135.04
Dipole, Da:	1.99
IP(EA), eV:	-10.64(0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methylbutyl pentanoate

Drug info:

PubChemData

Smile

CCCCC(=O)OCCC(C)C

DOS

IR

Vibrations