Geometry & MOs

Info

ID:	17984
PubChem CID:	531685
Reduced:	ClO2C18H35 (1)
Stoich.:	AB2C18D35 (1)
Weight, g/mol:	318.232558
ΔH_f, kcal/mol:	-182.3
Dipole, Da:	2.73
IP(EA), eV:	-10.6(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tridecan-2-yl 5-chloropentanoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCC(C)OC(=O)CCCCCl

DOS

IR

Vibrations