Geometry & MOs

Info

ID:	66078
PubChem CID:	46491037
Reduced:	FNOC8H8 (3)
Stoich.:	ABCD8E8 (3)
Weight, g/mol:	403.153206
ΔH_f, kcal/mol:	-224.24
Dipole, Da:	6.83
IP(EA), eV:	-9.32(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-phenyl-3-[[4-(pyridine-2-carbonylamino)benzoyl]amino]propanoate

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C2=CC=CC(=C2)C(F)(F)F)C)CC(=O)NC(CC(=O)OC)C3=CC=CC=C3

DOS

IR

Vibrations