Geometry & MOs

Info

ID:	273624
PubChem CID:	103771504
Reduced:	BrFNO2C13H17 (1)
Stoich.:	ABCD2E13F17 (1)
Weight, g/mol:	229.167794
ΔH_f, kcal/mol:	-132.62
Dipole, Da:	2.02
IP(EA), eV:	-10.02(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-2-methyloxolane-2-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations