Geometry & MOs

Info

ID:	201720
PubChem CID:	79571321
Reduced:	ON2C16H30 (1)
Stoich.:	AB2C16D30 (1)
Weight, g/mol:	282.267114
ΔH_f, kcal/mol:	-31.33
Dipole, Da:	3.83
IP(EA), eV:	-8.86(2.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(4-ethylazepan-1-yl)ethyl]-1-(methylamino)cyclopentyl]methanol

Drug info:

PubChemData

Smile

CNC1(CCCC1CCN(CC2CC2)C3CC3)CO

DOS

IR

Vibrations