Geometry & MOs

Info

ID:	356964
PubChem CID:	127293030
Reduced:	SO2N3C20H31 (1)
Stoich.:	AB2C3D20E31 (1)
Weight, g/mol:	342.18559
ΔH_f, kcal/mol:	-107.58
Dipole, Da:	5.87
IP(EA), eV:	-8.71(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-3-(4-fluorophenyl)-1H-pyrazole-5-carboxamide

Drug info:

PubChemData

Smile

CC1=C(SC(=C1)NC(=O)C(C)(C)C)C(=O)NC2CCN(C2)C3CCCC3

DOS

IR

Vibrations