Geometry & MOs

Info

ID:	195087
PubChem CID:	78632572
Reduced:	S2N3O3H15C16 (1)
Stoich.:	A2B3C3D15E16 (1)
Weight, g/mol:	347.135528
ΔH_f, kcal/mol:	-12.57
Dipole, Da:	9.4
IP(EA), eV:	-9.66(-1.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethylphenyl)sulfanyl-N-[1-(3-fluoro-4-methoxyphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC(C#N)(C1CC1)NC(=O)COC(=O)C2=CSC(=N2)C3=CC=CS3

DOS

IR

Vibrations