Geometry & MOs

Info

ID:	147508
PubChem CID:	53787164
Reduced:	FN2S2O6H11C14 (1)
Stoich.:	AB2C2D6E11F14 (1)
Weight, g/mol:	442.273262
ΔH_f, kcal/mol:	-220.21
Dipole, Da:	8.38
IP(EA), eV:	-9.76(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(Z)-[2-[(Z)-N-anilino-C-methylcarbonimidoyl]-7-methyl-1-benzofuran-4-yl]methylideneamino]aniline;ethane

Drug info:

PubChemData

Smile

C1C(=C(N2[C@@H](S1)C(C2=O)NC(=O)C(C3=CC=CS3)C(=O)O)C(=O)O)F

DOS

IR

Vibrations