Geometry & MOs

Info

ID:	168012
PubChem CID:	74911966
Reduced:	N2O4C17H20 (1)
Stoich.:	A2B4C17D20 (1)
Weight, g/mol:	337.068511
ΔH_f, kcal/mol:	-98.4
Dipole, Da:	3.61
IP(EA), eV:	-9.15(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-fluorophenyl)-2-indol-2-ylidene-3H-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CCCC1=NN=C(O1)C2=CC=C(C=C2)OCC=CC(=O)OCC

DOS

IR

Vibrations