Geometry & MOs

Info

ID:	231841
PubChem CID:	87574754
Reduced:	OSN6C22H22 (1)
Stoich.:	ABC6D22E22 (1)
Weight, g/mol:	140.118772
ΔH_f, kcal/mol:	86.42
Dipole, Da:	2.94
IP(EA), eV:	-8.43(-1.04)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-methyl-3-propylimidazol-1-ium-2-amine

Drug info:

PubChemData

Smile

C1CC(N(C1)CCC=O)N2C=C(C=N2)C3=CC(=C(N=C3)N)C4=NC5=CC=CC=C5S4

DOS

IR

Vibrations