Geometry & MOs

Info

ID:	25513
PubChem CID:	626099
Reduced:	PC20H21 (1)
Stoich.:	AB20C21 (1)
Weight, g/mol:	292.068177
ΔH_f, kcal/mol:	59.63
Dipole, Da:	1.25
IP(EA), eV:	-8.58(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[2-[(4-fluorophenyl)methylidene]hydrazinyl]-4-methylthiophene-2-carboxylate

Drug info:

PubChemData

Smile

C1C=CC=C1CCCP(C2=CC=CC=C2)C3=CC=CC=C3

DOS

IR

Vibrations