Geometry & MOs

Info

ID:	332586
PubChem CID:	127250872
Reduced:	FN3O3C24H28 (1)
Stoich.:	AB3C3D24E28 (1)
Weight, g/mol:	434.211804
ΔH_f, kcal/mol:	-88.99
Dipole, Da:	3.39
IP(EA), eV:	-8.45(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(5-fluoro-1-methylindol-3-yl)methyl]-2-[5-(2-phenoxyethyl)-1H-pyrazol-3-yl]morpholine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)CN2CCOC(C2)C3=NNC(=C3)CCOC4=CC=CC=C4F)OC

DOS

IR

Vibrations