Geometry & MOs

Info

ID:	291192
PubChem CID:	111978131
Reduced:	ION4C21H31 (1)
Stoich.:	ABC4D21E31 (1)
Weight, g/mol:	514.02291
ΔH_f, kcal/mol:	-3.35
Dipole, Da:	10.54
IP(EA), eV:	-7.91(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN=C(NCC1=CC=CC2=CC=CC=C21)NC3CCN(CC3)CCOC.I

DOS

IR

Vibrations