Geometry & MOs

Info

ID:	273507
PubChem CID:	103771260
Reduced:	BrNO3C14H20 (1)
Stoich.:	ABC3D14E20 (1)
Weight, g/mol:	227.188529
ΔH_f, kcal/mol:	-128.37
Dipole, Da:	3.57
IP(EA), eV:	-9.42(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxy-4-methylpentyl)-1-methylcyclopentane-1-carboxamide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations