Geometry & MOs

Info

ID:	411891
PubChem CID:	135084743
Reduced:	O3C17H24 (1)
Stoich.:	A3B17C24 (1)
Weight, g/mol:	727.888746
ΔH_f, kcal/mol:	-149.02
Dipole, Da:	6.36
IP(EA), eV:	-9.42(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2,6-bis(4-chloropyridin-2-yl)pyridine;iron

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations