Geometry & MOs

Info

ID:	289039
PubChem CID:	104332307
Reduced:	BrFNOC14H17 (1)
Stoich.:	ABCDE14F17 (1)
Weight, g/mol:	303.02702
ΔH_f, kcal/mol:	-98.14
Dipole, Da:	3.96
IP(EA), eV:	-9.9(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromo-3-methoxypropyl)-4-fluoro-2-methylbenzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)C(=O)NC2CCC(CC2)Br

DOS

IR

Vibrations