Geometry & MOs

Info

ID:	58026
PubChem CID:	24420952
Reduced:	SN3O7H23C24 (1)
Stoich.:	AB3C7D23E24 (1)
Weight, g/mol:	468.01961
ΔH_f, kcal/mol:	-206.58
Dipole, Da:	5.93
IP(EA), eV:	-8.43(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,4-difluorophenyl)-3-[[2-(thiophen-2-ylsulfonylamino)benzoyl]amino]thiourea

Drug info:

PubChemData

Smile

CC(=O)NC1=C(C=CC(=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)NC3=CC4=C(C=C3)OCCO4)OC

DOS

IR

Vibrations