Geometry & MOs

Info

ID:	290949
PubChem CID:	111646981
Reduced:	IO2N4C20H29 (1)
Stoich.:	AB2C4D20E29 (1)
Weight, g/mol:	491.16449
ΔH_f, kcal/mol:	-29.6
Dipole, Da:	3.63
IP(EA), eV:	-9.21(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-[2-(4-methoxyphenyl)ethyl]-2-[3-(oxolan-3-ylmethoxy)propyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CN=C(NCCCOCC1CCOC1)NCC2=NC=CC3=CC=CC=C32.I

DOS

IR

Vibrations