Geometry & MOs

Info

ID:	272861
PubChem CID:	103762556
Reduced:	NO3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	331.02193
ΔH_f, kcal/mol:	-107.6
Dipole, Da:	3.52
IP(EA), eV:	-9.71(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-N-[(2,2-dimethyl-1,3-dioxolan-4-yl)methyl]-5-fluorobenzamide

Drug info:

PubChemData

Smile

CC1(OCC(O1)CNC(=O)C2(CC2)C3=CC=CC=C3)C

DOS

IR

Vibrations