Geometry & MOs

Info

ID:	181276
PubChem CID:	76727517
Reduced:	O3N4H16C20 (1)
Stoich.:	A3B4C16D20 (1)
Weight, g/mol:	405.107319
ΔH_f, kcal/mol:	0.7
Dipole, Da:	10.12
IP(EA), eV:	-8.41(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[5-methyl-1-(4-nitrophenyl)-2-oxopyrido[3,2-b]indol-3-yl]-1,2,4-oxadiazolidin-5-one

Drug info:

PubChemData

Smile

CN1C2=C(C3=CC=CC=C31)N(C(=O)C=C2)C4=CC=C(C=C4)C5NC(=O)ON5

DOS

IR

Vibrations