Geometry & MOs

Info

ID:	425789
PubChem CID:	135128008
Reduced:	F3N5H14C20 (1)
Stoich.:	A3B5C14D20 (1)
Weight, g/mol:	257.141579
ΔH_f, kcal/mol:	-33.16
Dipole, Da:	2.08
IP(EA), eV:	-8.98(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methylperoxyphenyl)-2-propan-2-ylaniline

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)C(=NC(=N2)C3=NC=CN=C3)NC4=CC=CC(=C4)CC(F)(F)F

DOS

IR

Vibrations