Geometry & MOs

Info

ID:	221370
PubChem CID:	85272320
Reduced:	NC16H25 (1)
Stoich.:	AB16C25 (1)
Weight, g/mol:	231.175377
ΔH_f, kcal/mol:	-15.03
Dipole, Da:	0.79
IP(EA), eV:	-8.85(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1,3,5,7-tetramethyl-3-bicyclo[3.3.1]nonanyl)azanium;chloride

Drug info:

PubChemData

Smile

CCCCC1CC(C2=CC=CC=C12)NCCC

DOS

IR

Vibrations