Geometry & MOs

Info

ID:	2682
PubChem CID:	8248
Reduced:	SO4N6C20H32 (1)
Stoich.:	AB4C6D20E32 (1)
Weight, g/mol:	452.220575
ΔH_f, kcal/mol:	-95.43
Dipole, Da:	3.92
IP(EA), eV:	-9.03(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(N-benzyl-N'-methylcarbamimidoyl)-methylazanium;sulfate

Drug info:

PubChemData

Smile

C[NH2+]C(=NC)NCC1=CC=CC=C1.C[NH2+]C(=NC)NCC1=CC=CC=C1.[O-]S(=O)(=O)[O-]

DOS

IR

Vibrations