Geometry & MOs

Info

ID:	435158
PubChem CID:	135182478
Reduced:	SF3O4N5C13H20 (1)
Stoich.:	AB3C4D5E13F20 (1)
Weight, g/mol:	223.193614
ΔH_f, kcal/mol:	-325.21
Dipole, Da:	5.6
IP(EA), eV:	-9.16(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[cyclobutylmethyl(cyclopentyl)amino]butan-2-one

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CNC1C(N=C(S1)NCOC(F)(F)F)C(=N)C(=O)N

DOS

IR

Vibrations