Geometry & MOs

Info

ID:	225918
PubChem CID:	87246422
Reduced:	FN9O9H54C64 (1)
Stoich.:	AB9C9D54E64 (1)
Weight, g/mol:	209.244326
ΔH_f, kcal/mol:	-9.47
Dipole, Da:	16.35
IP(EA), eV:	-7.76(-2.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

lithium;azanide;1-N-pentylhexane-1,5-diamine

Drug info:

Smile

CC1CCCN1C2=NC3=C(C=CC(=C3)C(=O)O)N=C2C4=CC5=CC=CC=C5O4.CC(C)N(C)C1=NC2=C(C=CC(=C2)C(=O)O)N=C1C3=CC4=C(O3)C=CC(=C4)F.CN(C1CC1)C2=NC3=C(C=CC(=C3)C(=O)O)N=C2C4=CC5=CC=CC=C5O4

DOS

IR

Vibrations