Geometry & MOs

Info

ID:	31667
PubChem CID:	855997
Reduced:	SO2N5H9C12 (1)
Stoich.:	AB2C5D9E12 (1)
Weight, g/mol:	274.077599
ΔH_f, kcal/mol:	127.41
Dipole, Da:	9.11
IP(EA), eV:	-9.91(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetamido-4-methylphenyl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)N2C(=NN=N2)C3=CC=CS3)[N+](=O)[O-]

DOS

IR

Vibrations