Geometry & MOs

Info

ID:	10970
PubChem CID:	109466
Reduced:	O3C11H20 (1)
Stoich.:	A3B11C20 (1)
Weight, g/mol:	200.141244
ΔH_f, kcal/mol:	-129.9
Dipole, Da:	1.53
IP(EA), eV:	-9.52(-1.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-heptoxy-2-oxobutanal

Drug info:

PubChemData

Smile

CCCCCCCOC(C)C(=O)C=O

DOS

IR

Vibrations