Geometry & MOs

Info

ID:	357075
PubChem CID:	127293144
Reduced:	ON4C22H30 (1)
Stoich.:	AB4C22D30 (1)
Weight, g/mol:	370.21689
ΔH_f, kcal/mol:	-11.63
Dipole, Da:	4.92
IP(EA), eV:	-8.81(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-cyclopentylpyrrolidin-3-yl)-1-(4-fluorophenyl)-3,5-dimethylpyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC=C2)C)CC(=O)NC3CCN(C3)C4CCCC4

DOS

IR

Vibrations