Geometry & MOs

Info

ID:	69352
PubChem CID:	46530801
Reduced:	SN2F3O5C19H25 (1)
Stoich.:	AB2C3D5E19F25 (1)
Weight, g/mol:	316.102334
ΔH_f, kcal/mol:	-374.91
Dipole, Da:	4.58
IP(EA), eV:	-9.36(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1,2-benzoxazol-3-yl)-N-[1-(3,4-difluorophenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC=C1C(=O)NC(CCS(=O)(=O)C)C(=O)N2CCCC(C2)C(F)(F)F

DOS

IR

Vibrations