Geometry & MOs

Info

ID:	350656
PubChem CID:	127278691
Reduced:	ON4C17H26 (1)
Stoich.:	AB4C17D26 (1)
Weight, g/mol:	348.184921
ΔH_f, kcal/mol:	-23.37
Dipole, Da:	5.63
IP(EA), eV:	-9.1(0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclobutyl-N-[2-(6-fluoro-4H-1,3-benzodioxin-8-yl)ethyl]pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C=N1)C(CCC2)NC(=O)N3CCCC3C4CCC4

DOS

IR

Vibrations