Geometry & MOs

Info

ID:	298354
PubChem CID:	117648567
Reduced:	S2O4C23H24 (1)
Stoich.:	A2B4C23D24 (1)
Weight, g/mol:	486.095952
ΔH_f, kcal/mol:	-84.56
Dipole, Da:	1.19
IP(EA), eV:	-8.44(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

S-[(Z)-2-[4-[4-[4-[(Z)-2-prop-2-enoylsulfanylethenoxy]phenyl]phenyl]phenoxy]ethenyl] prop-2-enethioate

Drug info:

PubChemData

Smile

CC(=C)C(=O)SCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCCSC(=O)C=C

DOS

IR

Vibrations