Geometry & MOs

Info

ID:	323767
PubChem CID:	126676113
Reduced:	N3O3C20H25 (1)
Stoich.:	A3B3C20D25 (1)
Weight, g/mol:	218.13068
ΔH_f, kcal/mol:	-67.51
Dipole, Da:	4.33
IP(EA), eV:	-8.99(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(cyclopentyloxymethyl)phenyl]acetaldehyde

Drug info:

PubChemData

Smile

CNC(=O)/C(=C/C(=C\N(C)CC1=CC=CC=C1)/C(=O)NC2CCC2)/C=O

DOS

IR

Vibrations