Geometry & MOs

Info

ID:	17759
PubChem CID:	517559
Reduced:	NO5C23H23 (1)
Stoich.:	AB5C23D23 (1)
Weight, g/mol:	393.157623
ΔH_f, kcal/mol:	-143.57
Dipole, Da:	3.13
IP(EA), eV:	-9.55(-0.98)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-1-phenylpropan-1-ol;2-(4-hydroxybenzoyl)benzoic acid

Drug info:

PubChemData

Smile

CC(C(C1=CC=CC=C1)O)N.C1=CC=C(C(=C1)C(=O)C2=CC=C(C=C2)O)C(=O)O

DOS

IR

Vibrations