Geometry & MOs

Info

ID:	30421
PubChem CID:	841305
Reduced:	ClSN2O2H11C13 (1)
Stoich.:	ABC2D2E11F13 (1)
Weight, g/mol:	289.052112
ΔH_f, kcal/mol:	11.15
Dipole, Da:	4.98
IP(EA), eV:	-8.54(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-methyl-N-[(4-nitrophenyl)methylideneamino]thiophene-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)C=NNC(=O)C2=CC=C(S2)Cl

DOS

IR

Vibrations