Geometry & MOs

Info

ID:	7327
PubChem CID:	72169
Reduced:	ClNOC20H32 (1)
Stoich.:	ABCD20E32 (1)
Weight, g/mol:	337.217242
ΔH_f, kcal/mol:	-71.87
Dipole, Da:	11.95
IP(EA), eV:	-8.05(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclohexyl-3-(1-methylpyrrolidin-1-ium-1-yl)-1-phenylpropan-1-ol;chloride

Drug info:

PubChemData

Smile

C[N+]1(CCCC1)CCC(C2CCCCC2)(C3=CC=CC=C3)O.[Cl-]

DOS

IR

Vibrations