Geometry & MOs

Info

ID:	390136
PubChem CID:	134997279
Reduced:	NO11C22H27 (1)
Stoich.:	AB11C22D27 (1)
Weight, g/mol:	323.224915
ΔH_f, kcal/mol:	-414.75
Dipole, Da:	4.65
IP(EA), eV:	-9.09(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-2,2-dimethyl-N-[2-methyl-6-(2-phenylethyl)phenyl]propanamide

Drug info:

PubChemData

Smile

CC(=O)OCC1C(C(C(C(O1)OC(=O)C)C=[N+](C2=CC=C(C=C2)OC)[O-])OC(=O)C)OC(=O)C

DOS

IR

Vibrations