Geometry & MOs

Info

ID:	303470
PubChem CID:	124489773
Reduced:	BrNO2C5H8 (1)
Stoich.:	ABC2D5E8 (1)
Weight, g/mol:	355.178358
ΔH_f, kcal/mol:	-87.81
Dipole, Da:	2.96
IP(EA), eV:	-10.41(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1[C@@H](CN[C@H]1C(=O)O)Br

DOS

IR

Vibrations