Geometry & MOs

Info

ID:	83218
PubChem CID:	49857298
Reduced:	FN3O3H14C15 (1)
Stoich.:	AB3C3D14E15 (1)
Weight, g/mol:	309.157623
ΔH_f, kcal/mol:	-107.34
Dipole, Da:	5.3
IP(EA), eV:	-10.04(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(3-methoxyphenyl)-3-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations