Geometry & MOs

Info

ID:	287329
PubChem CID:	104236955
Reduced:	ClN3O3C13H18 (1)
Stoich.:	AB3C3D13E18 (1)
Weight, g/mol:	298.144806
ΔH_f, kcal/mol:	-126.01
Dipole, Da:	5.16
IP(EA), eV:	-9.1(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-chloro-4-[1-(methylamino)ethyl]phenoxy]-N-methyl-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1)OC(C)C(=O)NC(=O)N)Cl)NC

DOS

IR

Vibrations