Geometry & MOs

Info

ID:	263529
PubChem CID:	103375727
Reduced:	ON6C11H16 (1)
Stoich.:	AB6C11D16 (1)
Weight, g/mol:	205.110279
ΔH_f, kcal/mol:	66.04
Dipole, Da:	5.3
IP(EA), eV:	-9.28(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethylphenyl)-2-(2-hydroxyethoxy)acetonitrile

Drug info:

PubChemData

Smile

CN1C=C(C=N1)CC(C2=NN=C(C=C2)OC)NN

DOS

IR

Vibrations