Geometry & MOs

Info

ID:	282307
PubChem CID:	103921933
Reduced:	NO2C17H25 (1)
Stoich.:	AB2C17D25 (1)
Weight, g/mol:	258.173213
ΔH_f, kcal/mol:	-74.4
Dipole, Da:	3.25
IP(EA), eV:	-8.47(0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[1-[[1-(2-methoxyethyl)cyclopropyl]methylamino]ethyl]benzonitrile

Drug info:

PubChemData

Smile

CCOC1CC(C1)NC2CCCC3=C2C=C(C=C3)OC

DOS

IR

Vibrations