Geometry & MOs

Info

ID:	272862
PubChem CID:	103762557
Reduced:	BrFNO3C13H15 (1)
Stoich.:	ABCD3E13F15 (1)
Weight, g/mol:	301.112564
ΔH_f, kcal/mol:	-164.72
Dipole, Da:	2.91
IP(EA), eV:	-10.07(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(difluoromethoxy)-N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]benzamide

Drug info:

PubChemData

Smile

CC1(OCC(O1)CNC(=O)C2=CC(=CC(=C2)Br)F)C

DOS

IR

Vibrations