Geometry & MOs

Info

ID:	29810
PubChem CID:	837479
Reduced:	N2O3C18H20 (1)
Stoich.:	A2B3C18D20 (1)
Weight, g/mol:	313.131408
ΔH_f, kcal/mol:	-96.67
Dipole, Da:	5.8
IP(EA), eV:	-8.38(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[[(2R)-2-(2-methylphenoxy)propanoyl]amino]benzoate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1O[C@@H](C)C(=O)NC2=CC=C(C=C2)NC(=O)C

DOS

IR

Vibrations