Geometry & MOs

Info

ID:	63425
PubChem CID:	26758309
Reduced:	O5N6C22H24 (1)
Stoich.:	A5B6C22D24 (1)
Weight, g/mol:	409.127385
ΔH_f, kcal/mol:	-53.6
Dipole, Da:	2.64
IP(EA), eV:	-8.93(-2.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(benzylcarbamoylamino)-1-oxopropan-2-yl] 2-(1,3-dioxoisoindol-2-yl)acetate

Drug info:

PubChemData

Smile

CC(C)C[C@H](C(=O)N1CCN(CC1)C2=NC=CC=N2)N3C(=O)C4=C(C3=O)C(=CC=C4)[N+](=O)[O-]

DOS

IR

Vibrations