Geometry & MOs

Info

ID:	358407
PubChem CID:	127295952
Reduced:	ON5C21H29 (1)
Stoich.:	AB5C21D29 (1)
Weight, g/mol:	385.227789
ΔH_f, kcal/mol:	-2.16
Dipole, Da:	3.67
IP(EA), eV:	-8.7(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(3,5-dimethylpyrazol-1-yl)-3-fluorophenyl]-3-piperidin-1-ylpyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1C2=CC=CC(=C2)NC(=O)N3CCC(C3)N4CCCCC4)C

DOS

IR

Vibrations