Geometry & MOs

Info

ID:	276113
PubChem CID:	103820660
Reduced:	FNO3C16H20 (1)
Stoich.:	ABC3D16E20 (1)
Weight, g/mol:	295.1606
ΔH_f, kcal/mol:	-180.55
Dipole, Da:	4.33
IP(EA), eV:	-9.59(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-N-(4-hydroxy-3-methylsulfanylbutan-2-yl)benzamide

Drug info:

PubChemData

Smile

CCOC(=O)[C@@H]1CCCN(C1)C(=O)C2=C(C=C(C=C2)F)C

DOS

IR

Vibrations