Geometry & MOs

Info

ID:	25493
PubChem CID:	625861
Reduced:	SN2O2C15H18 (1)
Stoich.:	AB2C2D15E18 (1)
Weight, g/mol:	290.091141
ΔH_f, kcal/mol:	-31.36
Dipole, Da:	2.26
IP(EA), eV:	-8.34(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

18-thia-2,9-diazatetracyclo[9.7.0.03,9.012,17]octadeca-1,10,12(17)-triene-5-thione

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=C(N3CCOCC3)SC)C1=O

DOS

IR

Vibrations