Geometry & MOs

Info

ID:	409108
PubChem CID:	135081884
Reduced:	H10N10C15O16 (1)
Stoich.:	A10B10C15D16 (1)
Weight, g/mol:	270.136828
ΔH_f, kcal/mol:	72.28
Dipole, Da:	4.08
IP(EA), eV:	-11.08(-3.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-methylpropyl)-N-(4-phenylphenyl)nitramide

Drug info:

PubChemData

Smile

C1=C(C=C(C(=C1[N+](=O)[O-])N(CCCN(C2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

DOS

IR

Vibrations