Geometry & MOs

Info

ID:	330154
PubChem CID:	127247141
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	289.15904
ΔH_f, kcal/mol:	17.45
Dipole, Da:	5.47
IP(EA), eV:	-9.51(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[1-[(2-fluoro-4-methoxyphenyl)methyl]pyrrolidin-3-yl]-4-methyl-1H-pyrazole

Drug info:

PubChemData

Smile

CC1=C(NN=C1)C2CCN(C2)C(=O)CCC3=CC=NN3C

DOS

IR

Vibrations