Geometry & MOs

Info

ID:	410859
PubChem CID:	135083660
Reduced:	O3C27H32 (1)
Stoich.:	A3B27C32 (1)
Weight, g/mol:	224.071465
ΔH_f, kcal/mol:	-97.1
Dipole, Da:	2.2
IP(EA), eV:	-9.18(0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(=CC(=O)OC1CC2CCC1(C2(C)C)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)C

DOS

IR

Vibrations