Geometry & MOs

Info

ID:	120784
PubChem CID:	50744205
Reduced:	ClO2N3H18C23 (1)
Stoich.:	AB2C3D18E23 (1)
Weight, g/mol:	389.137556
ΔH_f, kcal/mol:	23.63
Dipole, Da:	1.61
IP(EA), eV:	-8.66(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[4-[(2-methyl-7-oxo-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methoxy]phenyl]benzamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)COC(=O)C2=NC3=CC=CC=C3N=C2NCC4=CC=CC=C4Cl

DOS

IR

Vibrations