Geometry & MOs

Info

ID:	362381
PubChem CID:	127307726
Reduced:	O3N4C13H22 (1)
Stoich.:	A3B4C13D22 (1)
Weight, g/mol:	314.174276
ΔH_f, kcal/mol:	-140.69
Dipole, Da:	2.5
IP(EA), eV:	-8.88(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,1-dimethyl-N-[(1-methylpyrrolidin-3-yl)methyl]-4-oxocinnoline-3-carboxamide

Drug info:

PubChemData

Smile

CN1CCC(C1)CN(C)C(=O)CN2CCC(=O)NC2=O

DOS

IR

Vibrations