Geometry & MOs

Info

ID:	401872
PubChem CID:	135053138
Reduced:	ON2F3C13H15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	280.157563
ΔH_f, kcal/mol:	-161.78
Dipole, Da:	3.07
IP(EA), eV:	-8.96(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,1-dianilino-4-methylpent-1-en-3-one

Drug info:

PubChemData

Smile

C=C(NC1=CC=CC=C1C(F)(F)F)N2CCOCC2

DOS

IR

Vibrations