Geometry & MOs

Info

ID:	407367
PubChem CID:	135079945
Reduced:	NOC13H21 (1)
Stoich.:	ABC13D21 (1)
Weight, g/mol:	300.102765
ΔH_f, kcal/mol:	-7.95
Dipole, Da:	3.96
IP(EA), eV:	-8.72(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E)-2-diazonio-2-(3,4-dimethyl-2-phenylphosphol-1-yl)-1-ethoxyethenolate

Drug info:

PubChemData

Smile

CCCC#CCCN1CCC[C@H]1CC=O

DOS

IR

Vibrations