Geometry & MOs

Info

ID:	434425
PubChem CID:	135174911
Reduced:	FNO2C18H26 (1)
Stoich.:	ABC2D18E26 (1)
Weight, g/mol:	307.1606
ΔH_f, kcal/mol:	-131.55
Dipole, Da:	5.85
IP(EA), eV:	-9.17(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-1-[4-[3-(1-sulfanylethylamino)cyclobutyl]oxyphenyl]butan-2-one

Drug info:

PubChemData

Smile

CCNC1CC(C1)OC2=CC(=CC(=C2)CCC(=O)C(C)C)F

DOS

IR

Vibrations