Geometry & MOs

Info

ID:	381492
PubChem CID:	134972248
Reduced:	OC5H9 (2)
Stoich.:	AB5C9 (2)
Weight, g/mol:	188.060407
ΔH_f, kcal/mol:	-127.89
Dipole, Da:	1.57
IP(EA), eV:	-9.68(2.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-4-methyl-5-(2-methylpropyl)-3H-furan-2-one

Drug info:

PubChemData

Smile

CC1([C@H]2CCC(O1)(CC2O)C)C

DOS

IR

Vibrations