Geometry & MOs

Info

ID:	4872
PubChem CID:	12209
Reduced:	O2C7H14 (1)
Stoich.:	A2B7C14 (1)
Weight, g/mol:	130.09938
ΔH_f, kcal/mol:	-120.44
Dipole, Da:	1.92
IP(EA), eV:	-10.86(0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylbutyl acetate

Drug info:

PubChemData

Smile

CCC(C)COC(=O)C

DOS

IR

Vibrations