Geometry & MOs

Info

ID:	370578
PubChem CID:	127339716
Reduced:	ON5C15H21 (1)
Stoich.:	AB5C15D21 (1)
Weight, g/mol:	388.171082
ΔH_f, kcal/mol:	25.42
Dipole, Da:	4.26
IP(EA), eV:	-9.07(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-difluorophenyl)-3-[4-(1-methylpyrazol-4-yl)piperidine-1-carbonyl]pyrrolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=NN1C)C(=O)N2CCC(CC2)C3=CN(N=C3)C

DOS

IR

Vibrations