Geometry & MOs

Info

ID:	410750
PubChem CID:	135083551
Reduced:	FNO2C12H14 (1)
Stoich.:	ABC2D12E14 (1)
Weight, g/mol:	158.057909
ΔH_f, kcal/mol:	-106.53
Dipole, Da:	1.24
IP(EA), eV:	-10.03(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-butyl-1,3-dioxolane-2,4-dione

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)/N=C/C1=CC(=CC=C1)F

DOS

IR

Vibrations