Geometry & MOs

Info

ID:	292028
PubChem CID:	114147575
Reduced:	NO2C14H21 (1)
Stoich.:	AB2C14D21 (1)
Weight, g/mol:	235.157229
ΔH_f, kcal/mol:	-97.13
Dipole, Da:	9.98
IP(EA), eV:	-8.79(0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(2,3-dihydro-1-benzofuran-2-ylmethylamino)pentan-2-ol

Drug info:

PubChemData

Smile

CC1=CC(=O)C=C(N1CC2CCCC(C2)O)C

DOS

IR

Vibrations