Geometry & MOs

Info

ID:	436027
PubChem CID:	135193418
Reduced:	BrO2N4C30H37 (1)
Stoich.:	AB2C4D30E37 (1)
Weight, g/mol:	476.137222
ΔH_f, kcal/mol:	-14.86
Dipole, Da:	1.04
IP(EA), eV:	-8.43(-1.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(1,3-dioxoisoindol-2-yl)phenyl]-5-[(3Z,5Z)-hepta-1,3,5-trien-2-yl]oxyisoindole-1,3-dione

Drug info:

PubChemData

Smile

CC(=C)C(=O)NCCCNCC1=C2C=CC(=CC2=C(C3=CC=CC=C31)CNCCCNC(=O)C(=C)C)Br

DOS

IR

Vibrations