Geometry & MOs

Info

ID:	329989
PubChem CID:	127246976
Reduced:	ON5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	336.136845
ΔH_f, kcal/mol:	28.46
Dipole, Da:	6.62
IP(EA), eV:	-8.56(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[1-(1,3-dimethylpyrazol-4-yl)sulfonylpyrrolidin-2-yl]-N-methylpyrazin-2-amine

Drug info:

PubChemData

Smile

CC1=C(C2=CC=CC=C2N1C)C(=O)N3CCCC3C4=CN=CC(=N4)NC

DOS

IR

Vibrations