Geometry & MOs

Info

ID:	285340
PubChem CID:	104100163
Reduced:	ClN2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	257.123878
ΔH_f, kcal/mol:	-122.79
Dipole, Da:	2.31
IP(EA), eV:	-9.79(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-4-methoxy-N-(2,2,2-trifluoroethyl)pentanamide

Drug info:

PubChemData

Smile

CC(CO)N(C)C(=O)CNC(=O)C1=CC=CC=C1Cl

DOS

IR

Vibrations