Geometry & MOs

Info

ID:	373451
PubChem CID:	131315534
Reduced:	FIOC10H10 (1)
Stoich.:	ABCD10E10 (1)
Weight, g/mol:	186.089209
ΔH_f, kcal/mol:	-29.22
Dipole, Da:	1.91
IP(EA), eV:	-9.16(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-4-oxooxan-3-yl) propanoate

Drug info:

PubChemData

Smile

C1CC1COC2=C(C=CC(=C2)I)F

DOS

IR

Vibrations