Geometry & MOs

Info

ID:	430281
PubChem CID:	135170345
Reduced:	NC11H17 (2)
Stoich.:	AB11C17 (2)
Weight, g/mol:	352.287849
ΔH_f, kcal/mol:	7.66
Dipole, Da:	2.46
IP(EA), eV:	-8.46(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-butyl-6-ethyl-2-methyl-7-(4-pyrrolidin-1-ylbutyl)quinoline

Drug info:

PubChemData

Smile

CCC/C(=C(\C)/C1=C(C=C(C(=C1)C)CN2CCCC2)N=C)/C(C)C

DOS

IR

Vibrations