Geometry & MOs

Info

ID:	155889
PubChem CID:	56368148
Reduced:	FNO3C10H10 (2)
Stoich.:	ABC3D10E10 (2)
Weight, g/mol:	494.154529
ΔH_f, kcal/mol:	-292.17
Dipole, Da:	4.83
IP(EA), eV:	-9.39(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-[4-(2-methoxyethylsulfonyl)benzoyl]piperidin-3-yl]methyl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCNC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)OC(F)F

DOS

IR

Vibrations