Geometry & MOs

Info

ID:	320385
PubChem CID:	126660097
Reduced:	NC10H19 (1)
Stoich.:	AB10C19 (1)
Weight, g/mol:	443.271882
ΔH_f, kcal/mol:	21.42
Dipole, Da:	1.78
IP(EA), eV:	-8.6(1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(2-aminopyridin-4-yl)amino]ethyl]-N-[5-[4-(C-ethyl-N-propylcarbonimidoyl)phenoxy]pentyl]thiohydroxylamine

Drug info:

PubChemData

Smile

CCC(CC=C1CC1)N(C)C

DOS

IR

Vibrations