Geometry & MOs

Info

ID:	3435
PubChem CID:	9654
Reduced:	ClINOC16H25 (1)
Stoich.:	ABCDE16F25 (1)
Weight, g/mol:	409.06694
ΔH_f, kcal/mol:	-59.78
Dipole, Da:	9.87
IP(EA), eV:	-7.53(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-chlorophenyl)-2-hydroxycyclohexyl]methyl-trimethylazanium;iodide

Drug info:

PubChemData

Smile

C[N+](C)(C)CC1CCCCC1(C2=CC=C(C=C2)Cl)O.[I-]

DOS

IR

Vibrations