Geometry & MOs

Info

ID:	332463
PubChem CID:	127250749
Reduced:	ClFN3O3C23H23 (1)
Stoich.:	ABC3D3E23F23 (1)
Weight, g/mol:	387.19582
ΔH_f, kcal/mol:	-100.61
Dipole, Da:	4.45
IP(EA), eV:	-9.22(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopentyl-[2-[5-[2-(2-fluorophenoxy)ethyl]-1H-pyrazol-3-yl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)CC2=CC=C(C=C2)F)C3=NNC(=C3)CCOC4=CC=CC=C4Cl

DOS

IR

Vibrations