Geometry & MOs

Info

ID:	27009
PubChem CID:	811135
Reduced:	SN2O3C18H22 (1)
Stoich.:	AB2C3D18E22 (1)
Weight, g/mol:	278.036128
ΔH_f, kcal/mol:	-85.51
Dipole, Da:	4.76
IP(EA), eV:	-9.57(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methoxy-5-nitrophenyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CCCN(CC1=NC(=CS1)C(=O)OCC)C(=O)C2=CC=CC=C2C

DOS

IR

Vibrations