Geometry & MOs

Info

ID:	290611
PubChem CID:	109766940
Reduced:	ICl2O2N4C18H25 (1)
Stoich.:	AB2C2D4E18F25 (1)
Weight, g/mol:	462.04501
ΔH_f, kcal/mol:	-34.1
Dipole, Da:	5.63
IP(EA), eV:	-8.82(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4,5-dichloro-1-methylpyrrol-2-yl)methyl]-3-(4-ethoxybutyl)-2-methylguanidine;hydroiodide

Drug info:

PubChemData

Smile

CN=C(NCC1=CC(=CC=C1)OCCOC)NCC2=CC(=C(N2C)Cl)Cl.I

DOS

IR

Vibrations