Geometry & MOs

Info

ID:	232755
PubChem CID:	87576896
Reduced:	ClN7C16H18 (1)
Stoich.:	AB7C16D18 (1)
Weight, g/mol:	383.234159
ΔH_f, kcal/mol:	111.34
Dipole, Da:	5.36
IP(EA), eV:	-8.5(-1.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sulfuric acid;2-(trimethylazaniumyl)tetradecanoate

Drug info:

PubChemData

Smile

CCC1=CN=C(N=C1)N2CCC(CC2)C3=NN=C4N3C=CN=C4Cl

DOS

IR

Vibrations