Geometry & MOs

Info

ID:	265021
PubChem CID:	103507196
Reduced:	OSN2C16H24 (1)
Stoich.:	ABC2D16E24 (1)
Weight, g/mol:	314.11227
ΔH_f, kcal/mol:	-36.26
Dipole, Da:	6.39
IP(EA), eV:	-8.01(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-amino-5-(3,4-dimethylpiperidin-1-yl)-4-methylsulfanylthiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1CCN(CC1C)C2=C(C(=C(S2)C(=O)C)N)C3CC3

DOS

IR

Vibrations