Geometry & MOs

Info

ID:	290902
PubChem CID:	111632410
Reduced:	ON5C25H37 (1)
Stoich.:	AB5C25D37 (1)
Weight, g/mol:	516.13861
ΔH_f, kcal/mol:	-5.39
Dipole, Da:	4.37
IP(EA), eV:	-8.56(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[[N-ethyl-N'-(naphthalen-2-ylmethyl)carbamimidoyl]amino]ethyl]-N-methylbenzamide;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC1=CC(=CC=C1)CN(CC)CC)NCCC2=CC(=CC=C2)C(=O)NC

DOS

IR

Vibrations