Geometry & MOs

Info

ID:	225515
PubChem CID:	85852677
Reduced:	BrN2C10H11 (1)
Stoich.:	AB2C10D11 (1)
Weight, g/mol:	309.009012
ΔH_f, kcal/mol:	49.31
Dipole, Da:	3.47
IP(EA), eV:	-8.5(0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,2-trichloro-N-[2-(1-hydroxy-2-methylpropyl)phenyl]acetamide

Drug info:

PubChemData

Smile

CN1C=CC=C1C2=CC(=CN2C)Br

DOS

IR

Vibrations