Geometry & MOs

Info

ID:	132545
PubChem CID:	51376877
Reduced:	ON5C24H39 (1)
Stoich.:	AB5C24D39 (1)
Weight, g/mol:	464.13925
ΔH_f, kcal/mol:	-25.91
Dipole, Da:	3.08
IP(EA), eV:	-8.52(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(4,6-dimethylpyrimidin-2-yl)-[4-[[(3R)-5-oxo-1-phenylpyrrolidine-3-carbonyl]amino]phenyl]sulfonylazanide

Drug info:

PubChemData

Smile

C1CCC(CC1)CN2C(=O)C3C(C4CCCCC4CC35CCCCC5)N6C2=NNN6

DOS

IR

Vibrations