Geometry & MOs

Info

ID:	229767
PubChem CID:	87568859
Reduced:	O2N5H21C24 (1)
Stoich.:	A2B5C21D24 (1)
Weight, g/mol:	355.988928
ΔH_f, kcal/mol:	53.92
Dipole, Da:	1.94
IP(EA), eV:	-8.98(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[1,3-bis(thietan-2-ylsulfanyl)propan-2-ylsulfanyl]thietane

Drug info:

PubChemData

Smile

CC1=CC=CC=C1CN2C(C3=CC=CC=C3C2=O)C(=O)NCN4C5=CC=CC=C5N=N4

DOS

IR

Vibrations