Geometry & MOs

Info

ID:	205503
PubChem CID:	80114310
Reduced:	OF2N2H6C9 (1)
Stoich.:	AB2C2D6E9 (1)
Weight, g/mol:	229.091435
ΔH_f, kcal/mol:	-74.22
Dipole, Da:	5.19
IP(EA), eV:	-10.45(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,3-difluorophenyl)-N-(3-hydroxypropyl)acetamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)F)CC(=O)NC#N

DOS

IR

Vibrations