Geometry & MOs

Info

ID:	120786
PubChem CID:	50744268
Reduced:	N3O4H19C22 (1)
Stoich.:	A3B4C19D22 (1)
Weight, g/mol:	409.082934
ΔH_f, kcal/mol:	-37.77
Dipole, Da:	1.53
IP(EA), eV:	-8.42(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-N-[2-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]benzamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)NC2=CC=C(C=C2)OCC3=CC(=O)N4C(=N3)C=C(O4)C

DOS

IR

Vibrations