Geometry & MOs

Info

ID:	25919
PubChem CID:	633771
Reduced:	NSnO4C22H43 (1)
Stoich.:	ABC4D22E43 (1)
Weight, g/mol:	393.05757
ΔH_f, kcal/mol:	-223.01
Dipole, Da:	4.5
IP(EA), eV:	-9.65(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-bromo-3-hydroxy-4-methoxy-17-methyl-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2,4,6-triene-12,13-dione

Drug info:

PubChemData

Smile

CCCC[Sn](CCCC)(CCCC)C=CC(C(=O)OC)NC(=O)OC(C)(C)C

DOS

IR

Vibrations