Geometry & MOs

Info

ID:	292414
PubChem CID:	115001308
Reduced:	NO4C10H21 (1)
Stoich.:	AB4C10D21 (1)
Weight, g/mol:	219.125929
ΔH_f, kcal/mol:	-195.82
Dipole, Da:	5.53
IP(EA), eV:	-9.51(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-ethoxyphenoxy)pentanenitrile

Drug info:

PubChemData

Smile

CCOCC(C)NC(C)(COC)C(=O)O

DOS

IR

Vibrations