Geometry & MOs

Info

ID:	31292
PubChem CID:	855536
Reduced:	SN2O6C14H16 (1)
Stoich.:	AB2C6D14E16 (1)
Weight, g/mol:	275.072848
ΔH_f, kcal/mol:	-181.48
Dipole, Da:	3.22
IP(EA), eV:	-7.89(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(methylcarbamothioylamino)phenyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1NC(=O)C2=CC=CO2)OC)NS(=O)(=O)C

DOS

IR

Vibrations