Geometry & MOs

Info

ID:	258899
PubChem CID:	103157380
Reduced:	O4N5C10H17 (1)
Stoich.:	A4B5C10D17 (1)
Weight, g/mol:	275.188529
ΔH_f, kcal/mol:	-120.62
Dipole, Da:	8.83
IP(EA), eV:	-10.18(-0.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-(2,3-dihydro-1-benzofuran-2-ylmethylamino)propan-2-ol

Drug info:

PubChemData

Smile

COC(CC(=O)O)CNC(=O)C1=CN(N=N1)CCN

DOS

IR

Vibrations