Geometry & MOs

Info

ID:	407609
PubChem CID:	135080358
Reduced:	BrClOC5H10 (1)
Stoich.:	ABCD5E10 (1)
Weight, g/mol:	211.076392
ΔH_f, kcal/mol:	-81.0
Dipole, Da:	2.0
IP(EA), eV:	-10.54(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-chloro-2-(2-methylphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC(C)([C@H](CO)Cl)Br

DOS

IR

Vibrations