Geometry & MOs

Info

ID:	327922
PubChem CID:	126691376
Reduced:	NO2C48H93 (1)
Stoich.:	AB2C48D93 (1)
Weight, g/mol:	410.162187
ΔH_f, kcal/mol:	-252.28
Dipole, Da:	0.19
IP(EA), eV:	-8.44(1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-chloro-1-[(2R,4R)-2-ethyloxan-4-yl]-2-[(4-methyltriazol-1-yl)methyl]imidazo[4,5-c]quinoline

Drug info:

PubChemData

Smile

CCCCC/C=C\C/C=C\CCCCCCCCC1(OCC(O1)C(C)(C)CC(C)(C)N(C)C)CCCCCCCCC(C)CC(C)CCCCC

DOS

IR

Vibrations