Geometry & MOs

Info

ID:	38862
PubChem CID:	8138073
Reduced:	F2O2N3H9C12 (1)
Stoich.:	A2B2C3D9E12 (1)
Weight, g/mol:	412.120526
ΔH_f, kcal/mol:	-97.53
Dipole, Da:	3.53
IP(EA), eV:	-9.24(-1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-phenyl-3-[(1H-pyrrole-2-carbonylamino)carbamoyl]benzenesulfonamide

Drug info:

PubChemData

Smile

C1=CNC(=C1)C(=O)NNC(=O)C2=CC(=C(C=C2)F)F

DOS

IR

Vibrations