Geometry & MOs

Info

ID:	302950
PubChem CID:	124403843
Reduced:	FN2O2C21H25 (1)
Stoich.:	AB2C2D21E25 (1)
Weight, g/mol:	436.122356
ΔH_f, kcal/mol:	-90.01
Dipole, Da:	6.34
IP(EA), eV:	-8.98(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-(3-chloro-4-methoxy-N-methylsulfonylanilino)-N-[(1S)-1,2,3,4-tetrahydronaphthalen-1-yl]propanamide

Drug info:

PubChemData

Smile

C1CCN(C1)[C@@H](CNC(=O)CCOC2=CC=CC=C2)C3=CC=C(C=C3)F

DOS

IR

Vibrations