Geometry & MOs

Info

ID:	412721
PubChem CID:	135085635
Reduced:	FNSH10C14 (1)
Stoich.:	ABCD10E14 (1)
Weight, g/mol:	208.091956
ΔH_f, kcal/mol:	15.59
Dipole, Da:	0.67
IP(EA), eV:	-8.81(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(5-trimethylsilylfuran-2-yl)but-3-yn-2-ol

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)SC(=N2)C3=CC=CC=C3F

DOS

IR

Vibrations