Geometry & MOs

Info

ID:	408343
PubChem CID:	135081109
Reduced:	ZnO2N8H40C45 (1)
Stoich.:	AB2C8D40E45 (1)
Weight, g/mol:	297.02159
ΔH_f, kcal/mol:	228.44
Dipole, Da:	7.33
IP(EA), eV:	-9.18(-1.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-bromo-N,N-bis(trimethylsilyloxy)ethenamine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC2=C(C=C1)C3=NC4=C5C=C(C=CC5=C([N-]4)N=C6C7=C(C=CC(=C7)C(C)(C)C)C(=N6)N=C8C9=C(C=CC(=C9)C(=O)O)C(=NC2=N3)[N-]8)C(C)(C)C.[Zn+2]

DOS

IR

Vibrations