Geometry & MOs

Info

ID:	82685
PubChem CID:	49856343
Reduced:	FNO3H16C17 (1)
Stoich.:	ABC3D16E17 (1)
Weight, g/mol:	317.081871
ΔH_f, kcal/mol:	-132.35
Dipole, Da:	3.61
IP(EA), eV:	-9.9(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-benzamido-3-(2-chlorophenyl)propanoate

Drug info:

PubChemData

Smile

COC(=O)CC(C1=CC=C(C=C1)F)NC(=O)C2=CC=CC=C2

DOS

IR

Vibrations