Geometry & MOs

Info

ID:	226152
PubChem CID:	87325912
Reduced:	O3N9H13C16 (1)
Stoich.:	A3B9C13D16 (1)
Weight, g/mol:	402.362668
ΔH_f, kcal/mol:	60.84
Dipole, Da:	5.29
IP(EA), eV:	-9.08(-1.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

decanoate;tetradecylphosphanium

Drug info:

PubChemData

Smile

C1CC1NC2=NC(=NC3=C(C=NN32)/C=C/4\C(=O)NC(=O)N4)N5C=C(N=C5)C=O

DOS

IR

Vibrations