Geometry & MOs

Info

ID:	163943
PubChem CID:	74381021
Reduced:	SO4N5C17H27 (1)
Stoich.:	AB4C5D17E27 (1)
Weight, g/mol:	415.185569
ΔH_f, kcal/mol:	-89.02
Dipole, Da:	7.47
IP(EA), eV:	-8.49(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dihydroxycyclobut-3-ene-1,2-dione;1-[(5-methoxyindol-3-ylidene)methylamino]-2-pentylguanidine

Drug info:

PubChemData

Smile

CCCCCN=C(N)NNC=C1C=NC2=C1C=C(C=C2)OC.CS(=O)(=O)O

DOS

IR

Vibrations