Geometry & MOs

Info

ID:	244803
PubChem CID:	99381478
Reduced:	FO2N4C20H25 (1)
Stoich.:	AB2C4D20E25 (1)
Weight, g/mol:	370.180504
ΔH_f, kcal/mol:	-96.52
Dipole, Da:	4.88
IP(EA), eV:	-8.86(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2R)-1-[1-(2-fluorophenyl)-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carbonyl]piperidin-2-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=C(C=C2)F)C)CC(=O)N3CCCC[C@H]3CC(=O)N

DOS

IR

Vibrations