Geometry & MOs

Info

ID:	194754
PubChem CID:	78586464
Reduced:	F2N2O3C20H20 (1)
Stoich.:	A2B2C3D20E20 (1)
Weight, g/mol:	382.171499
ΔH_f, kcal/mol:	-199.45
Dipole, Da:	2.64
IP(EA), eV:	-9.36(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(2,4-dimethylanilino)-2-oxoethyl]sulfanyl-N-(1,2,3,4-tetrahydronaphthalen-1-yl)acetamide

Drug info:

PubChemData

Smile

C1CC(C2=CC=CC=C2C1)NC(=O)CNC(=O)C3=CC=CC=C3OC(F)F

DOS

IR

Vibrations