Geometry & MOs

Info

ID:	240302
PubChem CID:	93576858
Reduced:	SO2N3C10H15 (1)
Stoich.:	AB2C3D10E15 (1)
Weight, g/mol:	238.113984
ΔH_f, kcal/mol:	-70.64
Dipole, Da:	2.36
IP(EA), eV:	-8.28(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-aminothiophen-2-yl)-[(3R)-3-ethylpiperidin-1-yl]methanone

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N(C)C)NC(=O)C1=C(C=CS1)N

DOS

IR

Vibrations