Geometry & MOs

Info

ID:	403094
PubChem CID:	135058716
Reduced:	O4H16C17 (1)
Stoich.:	A4B16C17 (1)
Weight, g/mol:	248.040421
ΔH_f, kcal/mol:	-87.52
Dipole, Da:	3.55
IP(EA), eV:	-8.66(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(Z)-2-chloro-1-phenoxyethenyl]-4-fluorobenzene

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)[C@H](C2=CC3=C(O2)C(=CC=C3)OC)O

DOS

IR

Vibrations