Geometry & MOs

Info

ID:	438169
PubChem CID:	135227798
Reduced:	NSCl2C17H19 (1)
Stoich.:	ABC2D17E19 (1)
Weight, g/mol:	259.173628
ΔH_f, kcal/mol:	13.74
Dipole, Da:	2.07
IP(EA), eV:	-8.75(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2Z,4Z)-2-butan-2-yl-3-fluoro-1-phenylhepta-2,4,6-trien-1-amine

Drug info:

PubChemData

Smile

CC(C)(C)SNC(C1=CC=C(C=C1)Cl)C2=CC=C(C=C2)Cl

DOS

IR

Vibrations