Geometry & MOs

Info

ID:	342970
PubChem CID:	127266133
Reduced:	FNSO4C16H24 (1)
Stoich.:	ABCD4E16F24 (1)
Weight, g/mol:	326.146427
ΔH_f, kcal/mol:	-209.9
Dipole, Da:	1.89
IP(EA), eV:	-9.27(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[[(1R,2S,3R)-3-ethoxy-2-methylsulfanylcyclobutyl]amino]-N-(3-fluorophenyl)propanamide

Drug info:

PubChemData

Smile

CCN(C1=CC(=CC=C1)F)S(=O)(=O)CC(C2CCOCC2)OC

DOS

IR

Vibrations