Geometry & MOs

Info

ID:	361187
PubChem CID:	127302131
Reduced:	SO2N4C18H18 (1)
Stoich.:	AB2C4D18E18 (1)
Weight, g/mol:	384.179755
ΔH_f, kcal/mol:	4.57
Dipole, Da:	7.0
IP(EA), eV:	-8.41(-1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-[3-(morpholine-4-carbonyl)piperidine-1-carbonyl]cinnolin-4-one

Drug info:

PubChemData

Smile

CN1C2=CC=CC=C2C(=O)C(=N1)C(=O)NC3=NC4=C(S3)CCCCC4

DOS

IR

Vibrations