Geometry & MOs

Info

ID:	329863
PubChem CID:	127246730
Reduced:	SO2N5C15H21 (1)
Stoich.:	AB2C5D15E21 (1)
Weight, g/mol:	285.15896
ΔH_f, kcal/mol:	-23.25
Dipole, Da:	3.28
IP(EA), eV:	-8.64(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(methylamino)pyridin-4-yl]pyrrolidin-1-yl]-(1-methylpyrazol-4-yl)methanone

Drug info:

PubChemData

Smile

CC1=NN(C=C1S(=O)(=O)N2CCCC2C3=CC(=NC=C3)NC)C

DOS

IR

Vibrations