Geometry & MOs

Info

ID:	303487
PubChem CID:	124489808
Reduced:	NF2O4C15H19 (1)
Stoich.:	AB2C4D15E19 (1)
Weight, g/mol:	405.0437
ΔH_f, kcal/mol:	-277.17
Dipole, Da:	5.67
IP(EA), eV:	-9.72(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S,3R)-3-amino-4-(4-iodophenyl)-2-[(2-methylpropan-2-yl)oxycarbonyl]butanoic acid

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)[C@@H]([C@H](CC1=CC(=C(C=C1)F)F)N)C(=O)O

DOS

IR

Vibrations