Geometry & MOs

Info

ID:	264975
PubChem CID:	103505503
Reduced:	SO2N3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	314.130028
ΔH_f, kcal/mol:	-71.82
Dipole, Da:	3.7
IP(EA), eV:	-8.3(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-amino-5-(4-hydroxy-4-methylpiperidin-1-yl)-4-methoxythiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1(CCN(CC1)C2=C(C(=C(S2)C(=O)N)N)C3CC3)O

DOS

IR

Vibrations