Geometry & MOs

Info

ID:	125600
PubChem CID:	50929497
Reduced:	FNO6C22H26 (1)
Stoich.:	ABC6D22E26 (1)
Weight, g/mol:	381.118793
ΔH_f, kcal/mol:	-258.55
Dipole, Da:	4.27
IP(EA), eV:	-8.6(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-[[4-(trifluoromethyl)phenyl]methylamino]ethyl] 4-methoxy-2-methylbenzoate

Drug info:

PubChemData

Smile

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC(=O)NCC2=CC=CC=C2F

DOS

IR

Vibrations