Geometry & MOs

Info

ID:	357006
PubChem CID:	127293072
Reduced:	O2N3C20H25 (1)
Stoich.:	A2B3C20D25 (1)
Weight, g/mol:	342.18559
ΔH_f, kcal/mol:	-15.31
Dipole, Da:	1.47
IP(EA), eV:	-8.95(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-1-(2-fluorophenyl)pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C2=NOC(=C2)C(=O)NC3CCN(C3)C4CCCC4

DOS

IR

Vibrations