Geometry & MOs

Info

ID:	329924
PubChem CID:	127246791
Reduced:	ON5C18H25 (1)
Stoich.:	AB5C18D25 (1)
Weight, g/mol:	346.179361
ΔH_f, kcal/mol:	14.55
Dipole, Da:	4.64
IP(EA), eV:	-8.44(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(dimethylamino)pyridin-4-yl]pyrrolidin-1-yl]-quinolin-6-ylmethanone

Drug info:

PubChemData

Smile

CC1=NN(C=C1)CCC(=O)N2CCCC2C3=CC(=NC=C3)N(C)C

DOS

IR

Vibrations