Geometry & MOs

Info

ID:	224576
PubChem CID:	85344991
Reduced:	O7C10H18 (1)
Stoich.:	A7B10C18 (1)
Weight, g/mol:	250.084124
ΔH_f, kcal/mol:	-314.28
Dipole, Da:	5.55
IP(EA), eV:	-10.28(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(2-formyl-6-methoxyphenoxy)but-2-enoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C(=O)OCC)OCOC)O

DOS

IR

Vibrations