Geometry & MOs

Info

ID:	445139
PubChem CID:	135264670
Reduced:	N2O2C9H10 (2)
Stoich.:	A2B2C9D10 (2)
Weight, g/mol:	480.052274
ΔH_f, kcal/mol:	-112.84
Dipole, Da:	4.94
IP(EA), eV:	-9.07(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dihydroisoindol-5-yl]methyl]-3-(2,4,6-trichlorophenyl)urea

Drug info:

PubChemData

Smile

CC1=NC2C=CC=C(C2C(=O)N1C3CCC(=O)NC3=O)NC(=O)C4CC4

DOS

IR

Vibrations