Geometry & MOs

Info

ID:	388247
PubChem CID:	134988642
Reduced:	O5C8H12 (1)
Stoich.:	A5B8C12 (1)
Weight, g/mol:	272.04119
ΔH_f, kcal/mol:	-209.74
Dipole, Da:	2.89
IP(EA), eV:	-9.89(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C(\C)/C(=O)OC)/O

DOS

IR

Vibrations