Geometry & MOs

Info

ID:	382990
PubChem CID:	134974460
Reduced:	N2O2S2C15H18 (1)
Stoich.:	A2B2C2D15E18 (1)
Weight, g/mol:	439.153206
ΔH_f, kcal/mol:	-20.55
Dipole, Da:	4.17
IP(EA), eV:	-8.85(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCSC(=C(C#N)C(C1=CC=CC=N1)OC(=O)C)SCC

DOS

IR

Vibrations