Geometry & MOs

Info

ID:	155514
PubChem CID:	56365850
Reduced:	ClNSF2O4H16C17 (1)
Stoich.:	ABCD2E4F16G17 (1)
Weight, g/mol:	490.059933
ΔH_f, kcal/mol:	-220.62
Dipole, Da:	4.11
IP(EA), eV:	-8.73(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-chloro-2-(difluoromethylsulfanyl)phenyl]-3-(4-morpholin-4-ylsulfonylphenyl)propanamide

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1C(=O)NC2=C(C(=CC=C2)Cl)SC(F)F)OC)OC

DOS

IR

Vibrations