Geometry & MOs

Info

ID:	45898
PubChem CID:	10518872
Reduced:	SF3H15C17 (1)
Stoich.:	AB3C15D17 (1)
Weight, g/mol:	308.173607
ΔH_f, kcal/mol:	-122.45
Dipole, Da:	4.9
IP(EA), eV:	-8.77(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4,5-trimethoxy-N-(1-methylpiperidin-4-yl)benzamide

Drug info:

PubChemData

Smile

C1CSCC(C2=CC=CC=C21)C3=CC=C(C=C3)C(F)(F)F

DOS

IR

Vibrations