Geometry & MOs

Info

ID:	387207
PubChem CID:	134984414
Reduced:	N2O3C11H18 (1)
Stoich.:	A2B3C11D18 (1)
Weight, g/mol:	145.110279
ΔH_f, kcal/mol:	-50.94
Dipole, Da:	5.89
IP(EA), eV:	-10.38(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2,3-trimethyl-3-nitrobutane

Drug info:

PubChemData

Smile

CC(C)(C)C(=O)C(C)(C#N)C(C)(C)[N+](=O)[O-]

DOS

IR

Vibrations