Geometry & MOs

Info

ID:	169927
PubChem CID:	75168673
Reduced:	BrSO4N5C19H26 (1)
Stoich.:	ABC4D5E19F26 (1)
Weight, g/mol:	557.06491
ΔH_f, kcal/mol:	-118.93
Dipole, Da:	4.92
IP(EA), eV:	-9.63(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

diphenyltin(2+);2-[(2-oxido-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

CC1=CN(N=N1)C2CCN(CC2NC(=O)OC(C)(C)C)S(=O)(=O)C3=CC=C(C=C3)Br

DOS

IR

Vibrations