Geometry & MOs

Info

ID:	405747
PubChem CID:	135075293
Reduced:	ClO3H13C16 (1)
Stoich.:	AB3C13D16 (1)
Weight, g/mol:	284.123256
ΔH_f, kcal/mol:	-72.31
Dipole, Da:	4.65
IP(EA), eV:	-9.63(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=O)C1=CC=CC=C1OC(C2=CC=CC=C2)C(=O)Cl

DOS

IR

Vibrations