Geometry & MOs

Info

ID:	411123
PubChem CID:	135083933
Reduced:	BrMgN2O2C18H31 (1)
Stoich.:	ABC2D2E18F31 (1)
Weight, g/mol:	308.246378
ΔH_f, kcal/mol:	-209.37
Dipole, Da:	10.36
IP(EA), eV:	-9.68(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(C-butyl-N-cyclohexylcarbonimidoyl)-cyclohexylcarbamic acid

Drug info:

PubChemData

Smile

CCCCC(=NC1CCCCC1)N(C2CCCCC2)C(=O)[O-].[Mg+2].[Br-]

DOS

IR

Vibrations