Geometry & MOs

Info

ID:	47103
PubChem CID:	10529597
Reduced:	ClF2N2O7H17C23 (1)
Stoich.:	AB2C2D7E17F23 (1)
Weight, g/mol:	470.278072
ΔH_f, kcal/mol:	-329.71
Dipole, Da:	5.66
IP(EA), eV:	-9.78(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 10-[[(2S)-2-amino-3-(4-phenylmethoxyphenyl)propyl]-hydroxyamino]-10-oxodecanoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OC[C@H]2[C@@H](C(C(O2)N3C=C(C(=O)NC3=O)Cl)(F)F)OC(=O)C4=CC=CC=C4

DOS

IR

Vibrations