Geometry & MOs

Info

ID:	22090
PubChem CID:	595979
Reduced:	SN3O4C15H15 (1)
Stoich.:	AB3C4D15E15 (1)
Weight, g/mol:	333.078327
ΔH_f, kcal/mol:	-10.62
Dipole, Da:	5.14
IP(EA), eV:	-9.42(-1.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(5-nitrothiophen-2-yl)methylideneamino]-4-propoxybenzamide

Drug info:

PubChemData

Smile

CCCOC1=CC=C(C=C1)C(=O)NN=CC2=CC=C(S2)[N+](=O)[O-]

DOS

IR

Vibrations