Geometry & MOs

Info

ID:	51247
PubChem CID:	12013889
Reduced:	ClNO3H10C14 (1)
Stoich.:	ABC3D10E14 (1)
Weight, g/mol:	308.995948
ΔH_f, kcal/mol:	-65.93
Dipole, Da:	3.61
IP(EA), eV:	-9.99(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(2,4-dichlorobenzoyl)-3,4-dihydropyrrolo[2,1-c][1,4]oxazin-1-one

Drug info:

PubChemData

Smile

C1COC(=O)C2=CC=C(N21)C(=O)C3=CC=C(C=C3)Cl

DOS

IR

Vibrations