Geometry & MOs

Info

ID:	424220
PubChem CID:	135121789
Reduced:	INO2C11H20 (1)
Stoich.:	ABC2D11E20 (1)
Weight, g/mol:	435.10189
ΔH_f, kcal/mol:	-67.59
Dipole, Da:	11.16
IP(EA), eV:	-7.45(-1.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(dimethylcarbamoyloxy)anilino]-2-oxoethyl]-diethyl-methylazanium;iodide

Drug info:

PubChemData

Smile

CCC[C@H]1C(=O)C=C(O1)C[N+](C)(C)C.[I-]

DOS

IR

Vibrations