Geometry & MOs

Info

ID:	319679
PubChem CID:	126657001
Reduced:	NC11H19 (1)
Stoich.:	AB11C19 (1)
Weight, g/mol:	505.23589
ΔH_f, kcal/mol:	7.62
Dipole, Da:	1.26
IP(EA), eV:	-8.13(0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4S)-5-[4-[ethoxy(hydroxy)methyl]piperidin-1-yl]-4-(naphthalen-2-ylsulfonylamino)-5-oxopentyl]guanidine

Drug info:

PubChemData

Smile

C/C=C\C(=C/C=C\N)\C(C)(C)C

DOS

IR

Vibrations