Geometry & MOs

Info

ID:	406939
PubChem CID:	135078956
Reduced:	OSnC10H16 (1)
Stoich.:	ABC10D16 (1)
Weight, g/mol:	270.035065
ΔH_f, kcal/mol:	-26.57
Dipole, Da:	2.16
IP(EA), eV:	-8.31(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-3-(5-oxodibenzothiophen-4-yl)prop-2-enoic acid

Drug info:

PubChemData

Smile

C[Sn](C)(C)CC1=CC=C(C=C1)O

DOS

IR

Vibrations