Geometry & MOs

Info

ID:	387479
PubChem CID:	134985527
Reduced:	N4O8C17H32 (1)
Stoich.:	A4B8C17D32 (1)
Weight, g/mol:	334.056602
ΔH_f, kcal/mol:	-104.0
Dipole, Da:	8.57
IP(EA), eV:	-10.53(-1.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-dimethoxyphosphoryl-1-nitro-1-phenylpropan-2-yl) nitrate

Drug info:

PubChemData

Smile

CCCCCC1(CC(N(O1)OC(C)(CCCCC)C[N+](=O)[O-])([N+](=O)[O-])[N+](=O)[O-])C

DOS

IR

Vibrations