Geometry & MOs

Info

ID:	54134
PubChem CID:	14720346
Reduced:	SN2O2C15H18 (1)
Stoich.:	AB2C2D15E18 (1)
Weight, g/mol:	395.951402
ΔH_f, kcal/mol:	-42.81
Dipole, Da:	6.65
IP(EA), eV:	-9.09(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3,5-dichloro-2,4-difluorophenyl)carbamothioyl]-2,6-difluorobenzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)N(CC2=CN=CC=C2)S(=O)(=O)C)C

DOS

IR

Vibrations