Geometry & MOs

Info

ID:	291224
PubChem CID:	111978196
Reduced:	ON5C25H41 (1)
Stoich.:	AB5C25D41 (1)
Weight, g/mol:	480.17499
ΔH_f, kcal/mol:	-40.41
Dipole, Da:	1.61
IP(EA), eV:	-8.68(0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-butylpiperidin-4-yl)-2-methyl-3-(naphthalen-1-ylmethyl)guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCCCN1CCC(CC1)NC(=NC)NCC(=O)N2CCC(CC2)CC3=CC=CC=C3

DOS

IR

Vibrations