Geometry & MOs

Info

ID:	139809
PubChem CID:	52600895
Reduced:	NOF3C14H16 (1)
Stoich.:	ABC3D14E16 (1)
Weight, g/mol:	256.131309
ΔH_f, kcal/mol:	-146.16
Dipole, Da:	4.83
IP(EA), eV:	-9.2(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

bis(prop-2-enyl)-[[4-(trifluoromethyl)phenyl]methyl]azanium

Drug info:

PubChemData

Smile

C=CCN(CC=C)CC1=CC=C(C=C1)OC(F)(F)F

DOS

IR

Vibrations