Geometry & MOs

Info

ID:	193546
PubChem CID:	78405490
Reduced:	SN3C12H21 (1)
Stoich.:	AB3C12D21 (1)
Weight, g/mol:	359.244701
ΔH_f, kcal/mol:	-8.8
Dipole, Da:	7.71
IP(EA), eV:	-8.61(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-[(5-methyl-2-oxo-3H-1,6-naphthyridine-3-carbonyl)amino]ethyl-bis(2-methylpropyl)azanium

Drug info:

PubChemData

Smile

CCCCC1C2CCCCN=C2NC(=S)N1

DOS

IR

Vibrations