Geometry & MOs

Info

ID:	155718
PubChem CID:	56367125
Reduced:	ClSF2N2O3H17C19 (1)
Stoich.:	ABC2D2E3F17G19 (1)
Weight, g/mol:	461.090155
ΔH_f, kcal/mol:	-188.64
Dipole, Da:	4.51
IP(EA), eV:	-8.72(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-piperidin-1-ylsulfonylphenyl)methyl]-2-(2-thiophen-2-yl-1,3-thiazol-4-yl)acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)N2CC(CC2=O)C(=O)NC3=C(C(=CC=C3)Cl)SC(F)F

DOS

IR

Vibrations