Geometry & MOs

Info

ID:	324460
PubChem CID:	126677716
Reduced:	SO4F6N6H24C29 (1)
Stoich.:	AB4C6D6E24F29 (1)
Weight, g/mol:	344.138091
ΔH_f, kcal/mol:	-361.77
Dipole, Da:	4.28
IP(EA), eV:	-8.93(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[(E)-but-2-en-2-yl]sulfanyl-2-methylprop-1-enyl]-N-(2-ethylphenyl)-1,3-thiazol-2-amine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)OC(F)(F)F)N\2C(=O)CS/C2=N\C(NC3=CC=C(C=C3)CCC4=NN(C=N4)C5=CC=C(C=C5)OC(F)(F)F)O

DOS

IR

Vibrations