Geometry & MOs

Info

ID:	260761
PubChem CID:	103202963
Reduced:	N6H14C15 (1)
Stoich.:	A6B14C15 (1)
Weight, g/mol:	280.132411
ΔH_f, kcal/mol:	142.6
Dipole, Da:	6.21
IP(EA), eV:	-8.43(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-4-[[(2-oxo-3,4-dihydro-1H-quinolin-6-yl)amino]methyl]pyrrole-2-carbonitrile

Drug info:

PubChemData

Smile

CN1C=C(C=C1C#N)CNC2=C(N=CC=C2)N3C=CC=N3

DOS

IR

Vibrations