Geometry & MOs

Info

ID:	171743
PubChem CID:	75421211
Reduced:	N2F3O3C15H17 (1)
Stoich.:	A2B3C3D15E17 (1)
Weight, g/mol:	429.09132
ΔH_f, kcal/mol:	-240.96
Dipole, Da:	2.94
IP(EA), eV:	-9.86(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopropyl-3-[1-(2,5-dimethoxyphenyl)ethyl]-2-prop-2-ynylguanidine;hydroiodide

Drug info:

PubChemData

Smile

CCONC(=O)C1CC(=O)N(C1C2=CC=C(C=C2)C(F)(F)F)C

DOS

IR

Vibrations