Geometry & MOs

Info

ID:	329862
PubChem CID:	127246729
Reduced:	ON5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	335.141596
ΔH_f, kcal/mol:	27.8
Dipole, Da:	2.31
IP(EA), eV:	-8.61(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-(1,3-dimethylpyrazol-4-yl)sulfonylpyrrolidin-2-yl]-N-methylpyridin-2-amine

Drug info:

PubChemData

Smile

CC1=NC2=CC=CC=C2N1CC(=O)N3CCCC3C4=CC(=NC=C4)NC

DOS

IR

Vibrations