Geometry & MOs

Info

ID:	288502
PubChem CID:	104317824
Reduced:	NO2C11H21 (1)
Stoich.:	AB2C11D21 (1)
Weight, g/mol:	224.104859
ΔH_f, kcal/mol:	-117.52
Dipole, Da:	3.73
IP(EA), eV:	-9.14(0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-hydroxybutoxy)-5-methoxybenzaldehyde

Drug info:

PubChemData

Smile

CC(CCN1CCCCC1C(=O)C)O

DOS

IR

Vibrations