Geometry & MOs

Info

ID:	73672
PubChem CID:	48419723
Reduced:	SN2O2F3H13C14 (1)
Stoich.:	AB2C2D3E13F14 (1)
Weight, g/mol:	377.104542
ΔH_f, kcal/mol:	-200.16
Dipole, Da:	2.64
IP(EA), eV:	-9.16(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-nitrophenyl)sulfinyl-N-[(6-propan-2-yloxypyridin-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

COC1=NC(=CC2=CC=CC=C21)C(=O)NCCSC(F)(F)F

DOS

IR

Vibrations