Geometry & MOs

Info

ID:	29383
PubChem CID:	833459
Reduced:	BrO3H15C16 (1)
Stoich.:	AB3C15D16 (1)
Weight, g/mol:	303.102606
ΔH_f, kcal/mol:	-79.99
Dipole, Da:	2.93
IP(EA), eV:	-9.16(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-chloro-2-methylphenoxy)-N-ethyl-N-phenylacetamide

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OC(=O)C2=CC=C(C=C2)OC)Br

DOS

IR

Vibrations