Geometry & MOs

Info

ID:	245987
PubChem CID:	103033799
Reduced:	SO5C10H20 (1)
Stoich.:	AB5C10D20 (1)
Weight, g/mol:	222.125594
ΔH_f, kcal/mol:	-244.46
Dipole, Da:	5.55
IP(EA), eV:	-10.16(0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-methoxy-3-methylbutoxy)benzaldehyde

Drug info:

PubChemData

Smile

CC(CC(=O)O)S(=O)(=O)CCC(C)(C)OC

DOS

IR

Vibrations