Geometry & MOs

Info

ID:	356950
PubChem CID:	127293016
Reduced:	FON6C20H27 (1)
Stoich.:	ABC6D20E27 (1)
Weight, g/mol:	346.273262
ΔH_f, kcal/mol:	-9.56
Dipole, Da:	10.26
IP(EA), eV:	-9.22(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-tert-butyl-N-(1-cyclopentylpyrrolidin-3-yl)-5-propan-2-ylpyrazole-3-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations