Geometry & MOs

Info

ID:	390843
PubChem CID:	135001210
Reduced:	NOSeBr3H12C16 (1)
Stoich.:	ABCD3E12F16 (1)
Weight, g/mol:	202.084763
ΔH_f, kcal/mol:	39.3
Dipole, Da:	5.34
IP(EA), eV:	-9.27(-1.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-ethyl (E)-4-trimethylsilylbut-2-enethioate

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C2=NC(=C[Se]2(Br)Br)C3=CC=C(C=C3)Br

DOS

IR

Vibrations