Geometry & MOs

Info

ID:	64616
PubChem CID:	29203303
Reduced:	NO5C24H29 (1)
Stoich.:	AB5C24D29 (1)
Weight, g/mol:	326.163043
ΔH_f, kcal/mol:	-159.59
Dipole, Da:	5.76
IP(EA), eV:	-8.59(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-N-[2-oxo-2-(4-phenoxyanilino)ethyl]propanamide

Drug info:

PubChemData

Smile

CCCOC1=C(C=C(C=C1)/C=C/C(=O)O[C@@H](C)C(=O)N(C)C2=CC=CC=C2)OCC

DOS

IR

Vibrations