Geometry & MOs

Info

ID:	384726
PubChem CID:	134977572
Reduced:	S2O3F6H24C32 (1)
Stoich.:	A2B3C6D24E32 (1)
Weight, g/mol:	312.055322
ΔH_f, kcal/mol:	-283.53
Dipole, Da:	4.87
IP(EA), eV:	-9.27(-2.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[2-(4-chlorophenyl)-3-oxocyclopropen-1-yl]-phenylmethyl] acetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2C(C2(OC3(C(C3C4=CC=CC=C4)C5=CC=CC=C5)OSC(F)(F)F)OSC(F)(F)F)C6=CC=CC=C6

DOS

IR

Vibrations