Geometry & MOs

Info

ID:	25765
PubChem CID:	630501
Reduced:	BrNOCl2H8C12 (1)
Stoich.:	ABCD2E8F12 (1)
Weight, g/mol:	554.240287
ΔH_f, kcal/mol:	-10.11
Dipole, Da:	8.0
IP(EA), eV:	-9.01(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

trimethylsilyl 5-oxo-2,3,4,6-tetrakis(trimethylsilyloxy)hexanoate

Drug info:

PubChemData

Smile

CC1=C(C(=O)C(=C(N1)C2=CC=C(C=C2)Br)Cl)Cl

DOS

IR

Vibrations