Geometry & MOs

Info

ID:	336901
PubChem CID:	127255908
Reduced:	PN3O3C24H30 (1)
Stoich.:	AB3C3D24E30 (1)
Weight, g/mol:	190.975
ΔH_f, kcal/mol:	-78.36
Dipole, Da:	4.15
IP(EA), eV:	-8.06(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

sodium;6-chloro-1,3-benzoxazol-3-id-2-one

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)OP(OC2=CC=C(C=C2)N(C)C)OC3=CC=CC(=C3)N(C)C

DOS

IR

Vibrations