Geometry & MOs

Info

ID:	337604
PubChem CID:	127258227
Reduced:	ClO3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	287.092436
ΔH_f, kcal/mol:	-182.29
Dipole, Da:	1.6
IP(EA), eV:	-10.3(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methylpropan-2-yl)oxycarbonylamino]-2-phenylacetic acid;hydrochloride

Drug info:

PubChemData

Smile

CCCCCC(=O)CCOC(=O)CCCCl

DOS

IR

Vibrations