Geometry & MOs

Info

ID:	429959
PubChem CID:	135170014
Reduced:	F3N4H13C15 (1)
Stoich.:	A3B4C13D15 (1)
Weight, g/mol:	178.084124
ΔH_f, kcal/mol:	-64.21
Dipole, Da:	4.51
IP(EA), eV:	-8.65(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethoxypropan-2-yl methyl carbonate

Drug info:

PubChemData

Smile

C=C/C(=C/N)/C(=NC1=CC(=NC2=CC=CC=C21)N)C(F)(F)F

DOS

IR

Vibrations