Geometry & MOs

Info

ID:	218259
PubChem CID:	85089099
Reduced:	NO5H25C27 (1)
Stoich.:	AB5C25D27 (1)
Weight, g/mol:	443.173273
ΔH_f, kcal/mol:	-123.46
Dipole, Da:	1.28
IP(EA), eV:	-8.9(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[benzyl(hydroxy)amino]methylidene]-1,5-bis(2-methoxyphenyl)pent-2-ene-1,5-dione

Drug info:

PubChemData

Smile

CC1(C(N(CO1)C2(C3=CC=CC=C3C4=CC=CC=C42)C5=CC=CC=C5)C(=O)OC)C(=O)OC

DOS

IR

Vibrations