Geometry & MOs

Info

ID:	383884
PubChem CID:	134975914
Reduced:	LiO2C7H11 (1)
Stoich.:	AB2C7D11 (1)
Weight, g/mol:	231.982463
ΔH_f, kcal/mol:	-115.75
Dipole, Da:	3.97
IP(EA), eV:	-7.49(1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 4,4,4-trichlorobutanoate

Drug info:

PubChemData

Smile

[Li+].COC1=C(CCCC1)[O-]

DOS

IR

Vibrations