Geometry & MOs

Info

ID:	434360
PubChem CID:	135174777
Reduced:	BrClO3N4C23H24 (1)
Stoich.:	ABC3D4E23F24 (1)
Weight, g/mol:	271.251129
ΔH_f, kcal/mol:	-27.0
Dipole, Da:	1.76
IP(EA), eV:	-9.21(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-4-(2,3-dimethylbutan-2-yloxy)-2,2-dimethylbutanamide

Drug info:

PubChemData

Smile

C1CNCC1CNCC2=CC(=CC(=C2)OCC3=NNC(=O)O3)/C=C/C4=C(C=C(C=C4)Cl)Br

DOS

IR

Vibrations