Geometry & MOs

Info

ID:	393930
PubChem CID:	135021991
Reduced:	FPSN2C25H28 (1)
Stoich.:	ABCD2E25F28 (1)
Weight, g/mol:	304.109944
ΔH_f, kcal/mol:	12.63
Dipole, Da:	5.5
IP(EA), eV:	-8.39(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(E)-2-(4-ethoxyphenyl)ethenyl]-4-phenylcyclobut-3-ene-1,2-dione

Drug info:

PubChemData

Smile

CC(C)[C@@H](CP(C1=CC=CC=C1)C2=CC=CC=C2)N(C)C(=S)NC3=CC=C(C=C3)F

DOS

IR

Vibrations