Geometry & MOs

Info

ID:	273214
PubChem CID:	103770697
Reduced:	BrClNO2C12H15 (1)
Stoich.:	ABCD2E12F15 (1)
Weight, g/mol:	211.120843
ΔH_f, kcal/mol:	-94.24
Dipole, Da:	2.6
IP(EA), eV:	-9.78(-1.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCCC(CNC(=O)C1=C(C=C(C=C1)Cl)Br)O

DOS

IR

Vibrations