Geometry & MOs

Info

ID:	375870
PubChem CID:	134221864
Reduced:	NOF3H18C19 (1)
Stoich.:	ABC3D18E19 (1)
Weight, g/mol:	361.165349
ΔH_f, kcal/mol:	-168.4
Dipole, Da:	3.52
IP(EA), eV:	-9.48(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(E)-3-(3,5-dimethylphenyl)-4,4,4-trifluorobut-1-enyl]-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)C(/C=C/C2=CC=C(C=C2)C(=O)N)C(F)(F)F)C

DOS

IR

Vibrations