Geometry & MOs

Info

ID:	259011
PubChem CID:	103157941
Reduced:	N3O3C12H23 (1)
Stoich.:	A3B3C12D23 (1)
Weight, g/mol:	211.193614
ΔH_f, kcal/mol:	-90.7
Dipole, Da:	2.2
IP(EA), eV:	-9.5(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-cyclopentyl-3-(2-cyclopropylethylamino)propan-2-ol

Drug info:

PubChemData

Smile

CCC(C)(C1=NOC(=N1)CC(CN)OC)OCC

DOS

IR

Vibrations