Geometry & MOs

Info

ID:	291280
PubChem CID:	111978419
Reduced:	IN5C24H30 (1)
Stoich.:	AB5C24D30 (1)
Weight, g/mol:	550.08042
ΔH_f, kcal/mol:	72.19
Dipole, Da:	2.1
IP(EA), eV:	-8.69(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-bromophenyl)methyl]-1-ethyl-3-[1-(oxolan-3-ylmethyl)piperidin-4-yl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CC1=NC(=CC=C1)N2CCC(CC2)NC(=NC)NCC3=CC=CC4=CC=CC=C43.I

DOS

IR

Vibrations