Geometry & MOs

Info

ID:	388728
PubChem CID:	134989999
Reduced:	ClNOSeC14H20 (1)
Stoich.:	ABCDE14F20 (1)
Weight, g/mol:	277.028595
ΔH_f, kcal/mol:	-35.88
Dipole, Da:	9.13
IP(EA), eV:	-8.83(-2.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(1,1,2,3,3,3-hexafluoropropyl)triazole-4-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC(=C2C(=C1)O[Se](=N2)Cl)C(C)(C)C

DOS

IR

Vibrations