Geometry & MOs

Info

ID:	401555
PubChem CID:	135051616
Reduced:	SeO4H16C19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	449.123878
ΔH_f, kcal/mol:	-110.22
Dipole, Da:	4.22
IP(EA), eV:	-8.57(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-nitro-4-(trifluoromethyl)-1-trityloxybenzene

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC2=C(C=C1)C=C(OC2=O)C3=CC=CC=C3[Se]C

DOS

IR

Vibrations