Geometry & MOs

Info

ID:	172475
PubChem CID:	75513057
Reduced:	ON5C17H33 (1)
Stoich.:	AB5C17D33 (1)
Weight, g/mol:	388.11239
ΔH_f, kcal/mol:	-47.66
Dipole, Da:	3.97
IP(EA), eV:	-9.03(1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-[2-(6-methylpyridin-3-yl)ethyl]azepane-1-carboximidamide;hydroiodide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1CCCN1CCCN=C(N)N2CCCCCC2

DOS

IR

Vibrations