Geometry & MOs

Info

ID:	362636
PubChem CID:	127308904
Reduced:	FSO2N3C20H24 (1)
Stoich.:	ABC2D3E20F24 (1)
Weight, g/mol:	386.211804
ΔH_f, kcal/mol:	-84.63
Dipole, Da:	1.07
IP(EA), eV:	-9.53(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(4-fluorophenyl)cyclopentyl]methyl]-2-(pyrazol-1-ylmethyl)morpholine-4-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)(CNC(=O)N2CCOC(C2)C3=NC=CS3)C4=CC=C(C=C4)F

DOS

IR

Vibrations