Geometry & MOs

Info

ID:	263060
PubChem CID:	103337656
Reduced:	N2O3C16H16 (1)
Stoich.:	A2B3C16D16 (1)
Weight, g/mol:	205.073893
ΔH_f, kcal/mol:	-66.91
Dipole, Da:	7.57
IP(EA), eV:	-9.12(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2R)-2-(2-cyanophenoxy)propanoate

Drug info:

PubChemData

Smile

C1COC(CN1C(=O)C2=CNC=CC2=O)C3=CC=CC=C3

DOS

IR

Vibrations