Geometry & MOs

Info

ID:	277257
PubChem CID:	103827522
Reduced:	N2S2F3O3C8H15 (1)
Stoich.:	A2B2C3D3E8F15 (1)
Weight, g/mol:	304.091535
ΔH_f, kcal/mol:	-306.14
Dipole, Da:	7.4
IP(EA), eV:	-9.71(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-[(5-ethylthiophen-2-yl)methyl]-4-methylsulfonylbutanamide

Drug info:

PubChemData

Smile

CS(=O)(=O)CCC(C(=O)NCCSC(F)(F)F)N

DOS

IR

Vibrations