Geometry & MOs

Info

ID:	197246
PubChem CID:	78941848
Reduced:	ClNO4H12C14 (1)
Stoich.:	ABC4D12E14 (1)
Weight, g/mol:	290.124212
ΔH_f, kcal/mol:	-49.69
Dipole, Da:	6.64
IP(EA), eV:	-9.77(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(methoxymethyl)phenyl]methyl]-2-(2,2,2-trifluoroethylamino)acetamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=C(C=C1)OC2=CC=CC=C2[N+](=O)[O-])Cl)O

DOS

IR

Vibrations