Geometry & MOs

Info

ID:	403233
PubChem CID:	135059305
Reduced:	BrSO2N4H15C18 (1)
Stoich.:	ABC2D4E15F18 (1)
Weight, g/mol:	429.125946
ΔH_f, kcal/mol:	25.96
Dipole, Da:	2.37
IP(EA), eV:	-9.05(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-oxo-N,1,4-triphenyl-6-thia-1,2,4,9-tetrazaspiro[4.4]non-2-ene-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)C1=NN(C2(N1C3=CC=CC=C3)NC(=O)CS2)C4=CC=C(C=C4)Br

DOS

IR

Vibrations