Geometry & MOs

Info

ID:	393897
PubChem CID:	135021924
Reduced:	PO2C20H23 (1)
Stoich.:	AB2C20D23 (1)
Weight, g/mol:	400.215078
ΔH_f, kcal/mol:	-49.77
Dipole, Da:	6.31
IP(EA), eV:	-7.36(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-bis[(E)-1-[4-(dimethylamino)phenyl]prop-1-en-2-yl]cyclobut-3-ene-1,2-dione

Drug info:

PubChemData

Smile

CC(C)(C)O/C(=C/C(=C)[PH+](C1=CC=CC=C1)C2=CC=CC=C2)/[O-]

DOS

IR

Vibrations