Geometry & MOs

Info

ID:	160033
PubChem CID:	57304407
Reduced:	O2N3C14H15 (2)
Stoich.:	A2B3C14D15 (2)
Weight, g/mol:	331.105587
ΔH_f, kcal/mol:	-44.97
Dipole, Da:	9.32
IP(EA), eV:	-8.44(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-3-(2-nitrophenoxy)-3-phenylpentanoic acid

Drug info:

PubChemData

Smile

CCN(CCO)C1=CC=C(C=C1)NC2(C(=NN(C2=O)C3=CC=CC=C3)NC(=O)C4=CC=CC=C4)NC(=O)C

DOS

IR

Vibrations