Geometry & MOs

Info

ID:	82
PubChem CID:	2090
Reduced:	N5C13H28 (2)
Stoich.:	A5B13C28 (2)
Weight, g/mol:	508.468942
ΔH_f, kcal/mol:	-14.98
Dipole, Da:	3.18
IP(EA), eV:	-9.17(0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[N'-[6-[[amino-[[N'-(2-ethylhexyl)carbamimidoyl]amino]methylidene]amino]hexyl]carbamimidoyl]-2-(2-ethylhexyl)guanidine

Drug info:

PubChemData

Smile

CCCCC(CC)CN=C(N)NC(=NCCCCCCN=C(N)NC(=NCC(CC)CCCC)N)N

DOS

IR

Vibrations