Geometry & MOs

Info

ID:	290612
PubChem CID:	109767224
Reduced:	IOCl2N4C14H25 (1)
Stoich.:	ABC2D4E14F25 (1)
Weight, g/mol:	495.04535
ΔH_f, kcal/mol:	-32.66
Dipole, Da:	6.58
IP(EA), eV:	-8.62(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOCCCCNC(=NC)NCC1=CC(=C(N1C)Cl)Cl.I

DOS

IR

Vibrations