Geometry & MOs

Info

ID:	19265
PubChem CID:	559547
Reduced:	S2N4O5C18H34 (1)
Stoich.:	A2B4C5D18E34 (1)
Weight, g/mol:	450.197063
ΔH_f, kcal/mol:	-163.7
Dipole, Da:	5.29
IP(EA), eV:	-8.72(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6,14,17,22,25-pentaoxa-1,3,9,11-tetrazabicyclo[9.8.8]heptacosa-2,9-diene-2,10-dithiol

Drug info:

PubChemData

Smile

C1COCCN=C(N2CCOCCOCCN(CCOCCOCC2)C(=N1)S)S

DOS

IR

Vibrations