Geometry & MOs

Info

ID:	23834
PubChem CID:	606541
Reduced:	NO2C8H8 (2)
Stoich.:	AB2C8D8 (2)
Weight, g/mol:	300.111007
ΔH_f, kcal/mol:	-111.84
Dipole, Da:	6.95
IP(EA), eV:	-9.55(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-hydroxy-3-phenyl-2-(pyridine-2-carbonylamino)propanoate

Drug info:

PubChemData

Smile

COC(=O)C(C(C1=CC=CC=C1)O)NC(=O)C2=CC=CC=N2

DOS

IR

Vibrations