Geometry & MOs

Info

ID:	63543
PubChem CID:	26758583
Reduced:	ClFNO4H19C20 (1)
Stoich.:	ABCD4E19F20 (1)
Weight, g/mol:	385.168936
ΔH_f, kcal/mol:	-190.41
Dipole, Da:	2.61
IP(EA), eV:	-9.56(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-1-oxo-1-(2-propan-2-ylanilino)propan-2-yl] 4-(4-fluorophenyl)-4-oxobutanoate

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1Cl)NC(=O)[C@@H](C)OC(=O)CCC(=O)C2=CC=C(C=C2)F

DOS

IR

Vibrations