Geometry & MOs

Info

ID:	438396
PubChem CID:	135228132
Reduced:	N5O6C28H41 (1)
Stoich.:	A5B6C28D41 (1)
Weight, g/mol:	413.24269
ΔH_f, kcal/mol:	-229.57
Dipole, Da:	8.91
IP(EA), eV:	-8.68(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[2-(ethoxymethyl)-1-(2-hydroxy-2-methylpropyl)imidazo[4,5-c]quinolin-4-yl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CCOCCOCC(=O)N[C@@H](C(C)C)C(=O)NC1=NC2=CC=CC=C2C3=C1N=C(N3CC(C)(C)O)COCC

DOS

IR

Vibrations