Geometry & MOs

Info

ID:	156017
PubChem CID:	56368792
Reduced:	O3N4C24H24 (1)
Stoich.:	A3B4C24D24 (1)
Weight, g/mol:	434.162391
ΔH_f, kcal/mol:	-55.89
Dipole, Da:	5.3
IP(EA), eV:	-9.57(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-N-[[1-[2-(3-methyl-2,4-dioxopyrimidin-1-yl)acetyl]piperidin-3-yl]methyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)NCC(=O)NCCC(=O)NCC3=CC=NC=C3

DOS

IR

Vibrations