Geometry & MOs

Info

ID:	155506
PubChem CID:	56365842
Reduced:	ClF2S2N3O3C16H16 (1)
Stoich.:	AB2C2D3E3F16G16 (1)
Weight, g/mol:	444.054454
ΔH_f, kcal/mol:	-158.55
Dipole, Da:	5.7
IP(EA), eV:	-9.53(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-2-(difluoromethylsulfanyl)phenyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=C(C(=CC=C2)Cl)SC(F)F

DOS

IR

Vibrations