Geometry & MOs

Info

ID:	352359
PubChem CID:	127283446
Reduced:	O4N5C20H23 (1)
Stoich.:	A4B5C20D23 (1)
Weight, g/mol:	366.169191
ΔH_f, kcal/mol:	-118.52
Dipole, Da:	5.11
IP(EA), eV:	-8.96(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperazine-1-carbonyl]-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=C(OC(=N1)CN2CCN(CC2)C(=O)CN3C(=O)C4=CC=CC=C4NC3=O)C

DOS

IR

Vibrations