Geometry & MOs

Info

ID:	366197
PubChem CID:	127319612
Reduced:	S2O3N5C11H17 (1)
Stoich.:	A2B3C5D11E17 (1)
Weight, g/mol:	385.03473
ΔH_f, kcal/mol:	-42.18
Dipole, Da:	9.94
IP(EA), eV:	-9.84(-1.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-bromophenyl)-N-(1,1-dioxothian-3-yl)cyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

C1CC(CS(=O)(=O)C1)NC(=O)CSC2=NN=NN2C3CC3

DOS

IR

Vibrations