Geometry & MOs

Info

ID:	1157
PubChem CID:	3869
Reduced:	N2O3C19H24 (1)
Stoich.:	A2B3C19D24 (1)
Weight, g/mol:	328.178693
ΔH_f, kcal/mol:	-108.6
Dipole, Da:	3.13
IP(EA), eV:	-9.22(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-hydroxy-5-[1-hydroxy-2-(4-phenylbutan-2-ylamino)ethyl]benzamide

Drug info:

PubChemData

Smile

CC(CCC1=CC=CC=C1)NCC(C2=CC(=C(C=C2)O)C(=O)N)O

DOS

IR

Vibrations