Geometry & MOs

Info

ID:	242643
PubChem CID:	97857697
Reduced:	BrNO2C14H18 (1)
Stoich.:	ABC2D14E18 (1)
Weight, g/mol:	337.088099
ΔH_f, kcal/mol:	-74.04
Dipole, Da:	5.4
IP(EA), eV:	-9.37(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-chloro-4-fluoro-N-[(1R)-2-hydroxy-1-(4-methoxyphenyl)ethyl]-N-methylbenzamide

Drug info:

PubChemData

Smile

C[C@H]([C@@H]1CCCCN1C(=O)C2=CC=CC=C2Br)O

DOS

IR

Vibrations