Geometry & MOs

Info

ID:	291194
PubChem CID:	111978135
Reduced:	ION5C27H38 (1)
Stoich.:	ABC5D27E38 (1)
Weight, g/mol:	528.03856
ΔH_f, kcal/mol:	-4.51
Dipole, Da:	13.67
IP(EA), eV:	-8.0(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-bromophenyl)methyl]-2-methyl-3-(1-phenylpiperidin-4-yl)guanidine;hydroiodide

Drug info:

PubChemData

Smile

CN=C(NCC(=O)N1CCC(CC1)CC2=CC=CC=C2)NC3CCN(CC3)C4=CC=CC=C4.I

DOS

IR

Vibrations