Geometry & MOs

Info

ID:	357245
PubChem CID:	127293778
Reduced:	O2N3C16H23 (1)
Stoich.:	A2B3C16D23 (1)
Weight, g/mol:	358.180504
ΔH_f, kcal/mol:	-54.89
Dipole, Da:	5.14
IP(EA), eV:	-8.78(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-1-(2-fluorophenyl)-4-hydroxypyrazole-3-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)N2CCC(C2)NC(=O)COC3=CN=CC=C3

DOS

IR

Vibrations