Geometry & MOs

Info

ID:	274936
PubChem CID:	103812705
Reduced:	FOSN2C14H19 (1)
Stoich.:	ABCD2E14F19 (1)
Weight, g/mol:	230.145285
ΔH_f, kcal/mol:	-86.63
Dipole, Da:	3.93
IP(EA), eV:	-8.67(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(3-ethylsulfanylcyclopentyl)butanamide

Drug info:

PubChemData

Smile

CCSC1CCC(C1)NC(=O)C2=CC(=C(C=C2)F)N

DOS

IR

Vibrations