Geometry & MOs

Info

ID:	222667
PubChem CID:	85308301
Reduced:	N2O4C11H16 (1)
Stoich.:	A2B4C11D16 (1)
Weight, g/mol:	285.072511
ΔH_f, kcal/mol:	-147.51
Dipole, Da:	7.27
IP(EA), eV:	-10.91(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[2-(2-diazoacetyl)phenyl]ethyl]-2,2,2-trifluoroacetamide

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)OCC1C2CN=NC2C(=O)O1

DOS

IR

Vibrations