Geometry & MOs

Info

ID:	357016
PubChem CID:	127293082
Reduced:	F2O2N3C19H23 (1)
Stoich.:	A2B2C3D19E23 (1)
Weight, g/mol:	370.21689
ΔH_f, kcal/mol:	-163.32
Dipole, Da:	1.07
IP(EA), eV:	-8.77(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCC(C2)NC(=O)C3=CC4=C(N3)C=CC=C4OC(F)F

DOS

IR

Vibrations