Geometry & MOs

Info

ID:	34121
PubChem CID:	7889910
Reduced:	N2O3H24C25 (1)
Stoich.:	A2B3C24D25 (1)
Weight, g/mol:	394.150427
ΔH_f, kcal/mol:	-69.05
Dipole, Da:	2.64
IP(EA), eV:	-8.74(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,5-dimethylphenyl)-2-[methyl-[2-[4-(trifluoromethyl)phenoxy]acetyl]amino]acetamide

Drug info:

PubChemData

Smile

C[C@@H](C(=O)N1CCC2=CC=CC=C21)OC(=O)C3=C4CCCCC4=NC5=CC=CC=C53

DOS

IR

Vibrations