Geometry & MOs

Info

ID:	248592
PubChem CID:	103082866
Reduced:	NOC13H27 (1)
Stoich.:	ABC13D27 (1)
Weight, g/mol:	274.168128
ΔH_f, kcal/mol:	-88.15
Dipole, Da:	1.2
IP(EA), eV:	-8.76(2.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[1-[(3-methoxycyclopentyl)amino]ethyl]phenoxy]acetonitrile

Drug info:

PubChemData

Smile

CCCC(CCC)NC1CCC(C1)OC

DOS

IR

Vibrations