Geometry & MOs

Info

ID:	207311
PubChem CID:	80374543
Reduced:	OSF2N3C14H15 (1)
Stoich.:	ABC2D3E14F15 (1)
Weight, g/mol:	290.075451
ΔH_f, kcal/mol:	-80.19
Dipole, Da:	0.68
IP(EA), eV:	-9.06(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-difluorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanone

Drug info:

PubChemData

Smile

CC(C1=CSC(=N1)NC(=O)CC2=CC(=C(C=C2)F)F)NC

DOS

IR

Vibrations