Geometry & MOs

Info

ID:	11255
PubChem CID:	112508
Reduced:	ClO2C25H41 (1)
Stoich.:	AB2C25D41 (1)
Weight, g/mol:	408.279508
ΔH_f, kcal/mol:	-144.87
Dipole, Da:	2.5
IP(EA), eV:	-9.04(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-pentadecylphenoxy)butanoyl chloride

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCC1=CC(=CC=C1)OC(CC)C(=O)Cl

DOS

IR

Vibrations