Geometry & MOs

Info

ID:	273249
PubChem CID:	103770763
Reduced:	BrNO4C15H22 (1)
Stoich.:	ABC4D15E22 (1)
Weight, g/mol:	245.081871
ΔH_f, kcal/mol:	-164.11
Dipole, Da:	5.17
IP(EA), eV:	-8.68(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(2-hydroxy-4-methylpentyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations