Geometry & MOs

Info

ID:	28125
PubChem CID:	825744
Reduced:	N2H9C11 (2)
Stoich.:	A2B9C11 (2)
Weight, g/mol:	263.098
ΔH_f, kcal/mol:	162.56
Dipole, Da:	9.79
IP(EA), eV:	-8.63(-2.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R)-1-(1-benzothiophen-3-yl)-2-morpholin-4-ylethanol

Drug info:

PubChemData

Smile

C1CCN(CC1)C2=CC=C(C=C2)C(=C3C=CC(=C(C#N)C#N)C=C3)C#N

DOS

IR

Vibrations