Geometry & MOs

Info

ID:	411387
PubChem CID:	135084210
Reduced:	OCl2N2C11H14 (1)
Stoich.:	AB2C2D11E14 (1)
Weight, g/mol:	172.063663
ΔH_f, kcal/mol:	-44.24
Dipole, Da:	3.87
IP(EA), eV:	-9.91(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1E)-2-diazonio-1-phenylbuta-1,3-dien-1-olate

Drug info:

PubChemData

Smile

CC(C)(C)N(C1=NC(=CC=C1)Cl)C(=O)CCl

DOS

IR

Vibrations