Geometry & MOs

Info

ID:	413523
PubChem CID:	135086472
Reduced:	BrOSiN2F3C10H16 (1)
Stoich.:	ABCD2E3F10G16 (1)
Weight, g/mol:	216.099774
ΔH_f, kcal/mol:	-202.41
Dipole, Da:	6.95
IP(EA), eV:	-10.03(-0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-(2-ethyl-1,3-dioxolan-2-yl)-3-oxobutanoate

Drug info:

PubChemData

Smile

C[Si](C)(C)CCOCN1C(=CC(=N1)C(F)(F)F)Br

DOS

IR

Vibrations