Geometry & MOs

Info

ID:	17448
PubChem CID:	499392
Reduced:	CrNO5H12C16 (1)
Stoich.:	ABC5D12E16 (1)
Weight, g/mol:	350.012052
ΔH_f, kcal/mol:	99.7
Dipole, Da:	7.15
IP(EA), eV:	0.0(0.0)
Spin(S_z, S²):	0.500000, 2.826766
Charge, e:	-1

Chem-info

IUPAC name:

None

Drug info:

PubChemData

Smile

[CH2][CH][CH][CH][CH-]C=CC1=CC=C(C=C1)[N+](=O)[O-].[C-]#[O+].[C-]#[O+].[C-]#[O+].[Cr]

DOS

IR

Vibrations