Geometry & MOs

Info

ID:	258951
PubChem CID:	103157526
Reduced:	O2N4C11H14 (1)
Stoich.:	A2B4C11D14 (1)
Weight, g/mol:	281.181336
ΔH_f, kcal/mol:	18.53
Dipole, Da:	2.32
IP(EA), eV:	-9.59(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-[(2-methyl-1-thiophen-2-ylpropyl)amino]propan-2-ol

Drug info:

PubChemData

Smile

COC(CC1=NC(=NO1)C2=CC=CC=N2)CN

DOS

IR

Vibrations