Geometry & MOs

Info

ID:	328744
PubChem CID:	126727205
Reduced:	O4C13H16 (1)
Stoich.:	A4B13C16 (1)
Weight, g/mol:	307.98287
ΔH_f, kcal/mol:	-172.91
Dipole, Da:	5.09
IP(EA), eV:	-9.6(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-chloro-2-(1-iodopentyl)benzene

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C(=O)OCCCC(=O)O)C

DOS

IR

Vibrations