Geometry & MOs

Info

ID:	63560
PubChem CID:	26758626
Reduced:	SN2O4C25H26 (1)
Stoich.:	AB2C4D25E26 (1)
Weight, g/mol:	375.128214
ΔH_f, kcal/mol:	-90.67
Dipole, Da:	9.51
IP(EA), eV:	-9.18(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl] 4-(4-fluorophenyl)-4-oxobutanoate

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=O)C2=CC=C(C=C2)C(=O)C3=CC=CC=C3

DOS

IR

Vibrations