Geometry & MOs

Info

ID:	244377
PubChem CID:	99344382
Reduced:	Cl2F2N2O4H20C21 (1)
Stoich.:	A2B2C2D4E20F21 (1)
Weight, g/mol:	364.215078
ΔH_f, kcal/mol:	-206.67
Dipole, Da:	2.93
IP(EA), eV:	-9.26(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-2-cyclopropyl-2-[[2-(4-methylphenyl)acetyl]amino]ethyl]-2-(4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

C1CC1[C@@H](CNC(=O)COC2=C(C=C(C=C2)F)Cl)NC(=O)COC3=C(C=C(C=C3)F)Cl

DOS

IR

Vibrations