Geometry & MOs

Info

ID:	273370
PubChem CID:	103770974
Reduced:	BrFNO2C13H17 (1)
Stoich.:	ABCD2E13F17 (1)
Weight, g/mol:	289.204179
ΔH_f, kcal/mol:	-131.67
Dipole, Da:	2.25
IP(EA), eV:	-9.9(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-2-(5,6,7,8-tetrahydronaphthalen-2-yl)acetamide

Drug info:

PubChemData

Smile

CC(C)CC(CNC(=O)C1=C(C=CC(=C1)Br)F)O

DOS

IR

Vibrations