Geometry & MOs

Info

ID:	150420
PubChem CID:	53790110
Reduced:	NO2C11H11 (2)
Stoich.:	AB2C11D11 (2)
Weight, g/mol:	94.006622
ΔH_f, kcal/mol:	-100.21
Dipole, Da:	3.5
IP(EA), eV:	-9.51(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

fluoromethyl hydrogen carbonate

Drug info:

PubChemData

Smile

CC1=NC(=C(C(C1C(=O)OC)C2=CC=CC=C2)C(=O)OCC3=CC=CC=N3)C

DOS

IR

Vibrations