Geometry & MOs

Info

ID:	172110
PubChem CID:	75468677
Reduced:	ClION5C15H21 (1)
Stoich.:	ABCD5E15F21 (1)
Weight, g/mol:	461.07463
ΔH_f, kcal/mol:	41.29
Dipole, Da:	1.51
IP(EA), eV:	-9.31(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(2,4-dimethyl-1,3-thiazol-5-yl)methyl]-3-ethyl-2-[(6-methoxypyridin-2-yl)methyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC1=NOC(=N1)C)NC(C)C2=CC=CC=C2Cl.I

DOS

IR

Vibrations