Geometry & MOs

Info

ID:	242583
PubChem CID:	97857444
Reduced:	SN3O4C18H25 (1)
Stoich.:	AB3C4D18E25 (1)
Weight, g/mol:	274.113984
ΔH_f, kcal/mol:	-165.36
Dipole, Da:	6.66
IP(EA), eV:	-9.43(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-3-[3-(3-methylthiophen-2-yl)anilino]butanamide

Drug info:

PubChemData

Smile

C[C@H]1C(=O)N(C(=O)N1)CC2=CC=CC=C2CS(=O)(=O)N3CCC(CC3)C

DOS

IR

Vibrations