Geometry & MOs

Info

ID:	264775
PubChem CID:	103489724
Reduced:	NOC6H12 (2)
Stoich.:	ABC6D12 (2)
Weight, g/mol:	280.215078
ΔH_f, kcal/mol:	-84.34
Dipole, Da:	4.8
IP(EA), eV:	-9.61(0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopropylamino)-2-[2-(1-ethoxypropan-2-yloxy)ethyl]cyclopentane-1-carbonitrile

Drug info:

PubChemData

Smile

CCCNC(CCOC(C)COCC)C#N

DOS

IR

Vibrations