Geometry & MOs

Info

ID:	30529
PubChem CID:	841455
Reduced:	O3N4C14H16 (1)
Stoich.:	A3B4C14D16 (1)
Weight, g/mol:	290.036128
ΔH_f, kcal/mol:	-1.09
Dipole, Da:	3.06
IP(EA), eV:	-9.33(-1.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-thiophen-2-ylethylideneamino) 4-nitrobenzoate

Drug info:

PubChemData

Smile

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=C(C=CC=C2C)C

DOS

IR

Vibrations