Geometry & MOs

Info

ID:	245331
PubChem CID:	99443373
Reduced:	ClFN2O4H14C18 (1)
Stoich.:	ABC2D4E14F18 (1)
Weight, g/mol:	434.077028
ΔH_f, kcal/mol:	-154.89
Dipole, Da:	2.13
IP(EA), eV:	-8.68(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-fluorophenyl)-3-[[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]methylsulfonyl]propanamide

Drug info:

PubChemData

Smile

C1[C@H](CN(C1=O)C2=CC3=C(C=C2)OCO3)C(=O)NC4=C(C=CC(=C4)Cl)F

DOS

IR

Vibrations