Geometry & MOs

Info

ID:	406015
PubChem CID:	135076293
Reduced:	CrNO5H9C10 (1)
Stoich.:	ABC5D9E10 (1)
Weight, g/mol:	229.048741
ΔH_f, kcal/mol:	-24.56
Dipole, Da:	5.76
IP(EA), eV:	-7.21(0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-1-(4-cyanophenyl)-2-diazonio-3-methoxy-3-oxoprop-1-en-1-olate

Drug info:

PubChemData

Smile

CN(C)C(=[Cr])C=C.[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+].[C-]#[O+]

DOS

IR

Vibrations