Geometry & MOs

Info

ID:	191504
PubChem CID:	78154939
Reduced:	NO5C12H19 (1)
Stoich.:	AB5C12D19 (1)
Weight, g/mol:	357.157623
ΔH_f, kcal/mol:	-238.92
Dipole, Da:	7.87
IP(EA), eV:	-10.21(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-amino-3-hydroxy-2-(hydroxymethyl)propyl] 2-(3-benzoylphenyl)propanoate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)CN1CCC(=O)CC1C(=O)O

DOS

IR

Vibrations