Geometry & MOs

Info

ID:	362389
PubChem CID:	127307734
Reduced:	N4O4C13H22 (1)
Stoich.:	A4B4C13D22 (1)
Weight, g/mol:	344.184841
ΔH_f, kcal/mol:	-173.54
Dipole, Da:	4.02
IP(EA), eV:	-9.05(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-N-(3-morpholin-4-ylbutan-2-yl)-4-oxocinnoline-3-carboxamide

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)CN2CC(=O)NC2=O

DOS

IR

Vibrations