Geometry & MOs

Info

ID:	131361
PubChem CID:	51195560
Reduced:	FO2N3C16H20 (1)
Stoich.:	AB2C3D16E20 (1)
Weight, g/mol:	392.171162
ΔH_f, kcal/mol:	-82.81
Dipole, Da:	3.24
IP(EA), eV:	-9.01(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-acetamido-3-(4-methylphenyl)-N-[1-[3-(trifluoromethyl)phenyl]ethyl]propanamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1CCCNC(=O)C2=CC(=C(C=C2)OC)F)C

DOS

IR

Vibrations