Geometry & MOs

Info

ID:	395996
PubChem CID:	135027170
Reduced:	NOSC12H14 (2)
Stoich.:	ABCD12E14 (2)
Weight, g/mol:	298.03885
ΔH_f, kcal/mol:	-2.1
Dipole, Da:	5.61
IP(EA), eV:	-7.91(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-1-(2-bromophenyl)-4-trimethylsilylbut-3-en-1-ol

Drug info:

PubChemData

Smile

C1COCCN1/C(=C\C2=CC=CC=C2)/SC(C3=CC=CC=C3)C(=S)N4CCOCC4

DOS

IR

Vibrations