Geometry & MOs

Info

ID:	393383
PubChem CID:	135020356
Reduced:	SN2O3C19H22 (1)
Stoich.:	AB2C3D19E22 (1)
Weight, g/mol:	336.11503
ΔH_f, kcal/mol:	-65.34
Dipole, Da:	4.44
IP(EA), eV:	-9.14(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E)-1-benzo[e][1]benzofuran-1-ylidenebenzo[e][1]benzofuran

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N(C(=O)C)NC(C)/C=C/C2=CC=CC=C2

DOS

IR

Vibrations