Geometry & MOs

Info

ID:	357002
PubChem CID:	127293068
Reduced:	FON6C20H27 (1)
Stoich.:	ABC6D20E27 (1)
Weight, g/mol:	384.23254
ΔH_f, kcal/mol:	-9.51
Dipole, Da:	9.36
IP(EA), eV:	-9.19(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-1-(4-fluorophenyl)-5-propan-2-ylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NN=NN1C(CC2=CC=C(C=C2)F)C(=O)NC3CCN(C3)C4CCCC4

DOS

IR

Vibrations