Geometry & MOs

Info

ID:	187374
PubChem CID:	77566770
Reduced:	NOC9H15 (2)
Stoich.:	ABC9D15 (2)
Weight, g/mol:	350.130028
ΔH_f, kcal/mol:	-115.42
Dipole, Da:	2.25
IP(EA), eV:	-9.32(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-amino-2-(1,1-dioxo-2H-thiopyran-4-yl)-4-hydroxy-6-phenylhexanamide

Drug info:

PubChemData

Smile

CC(C)CCC(CC(C(CCC1=CC=CC=C1)N)O)C(=O)N

DOS

IR

Vibrations