Geometry & MOs

Info

ID:	53576
PubChem CID:	14716734
Reduced:	O6C35H42 (1)
Stoich.:	A6B35C42 (1)
Weight, g/mol:	382.983211
ΔH_f, kcal/mol:	-218.19
Dipole, Da:	4.24
IP(EA), eV:	-8.98(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-1-[(2-chlorophenyl)methyl]pyridin-1-ium;hexafluorophosphate

Drug info:

PubChemData

Smile

CCCCCCC(C)C(=O)C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC(=O)C3=CC=C(C=C3)OCCCCCC

DOS

IR

Vibrations