Geometry & MOs

Info

ID:	320001
PubChem CID:	126657786
Reduced:	NC11H25 (1)
Stoich.:	AB11C25 (1)
Weight, g/mol:	453.156767
ΔH_f, kcal/mol:	-51.72
Dipole, Da:	1.82
IP(EA), eV:	-9.3(3.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(5-chloropyridin-2-yl)-2-[[[4-(N,N-dimethylcarbamimidoyl)phenyl]-hydroxymethyl]amino]-5-methoxybenzamide

Drug info:

PubChemData

Smile

CCCCC(CCCN)C(C)C

DOS

IR

Vibrations