Geometry & MOs

Info

ID:	275967
PubChem CID:	103819543
Reduced:	NO3C11H15 (1)
Stoich.:	AB3C11D15 (1)
Weight, g/mol:	405.03425
ΔH_f, kcal/mol:	-112.24
Dipole, Da:	2.1
IP(EA), eV:	-9.35(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-bromo-4-chlorophenyl)-2-[(2-methylpropan-2-yl)oxycarbonyl-propylamino]acetic acid

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=CN=C1)OC(C)C

DOS

IR

Vibrations