Geometry & MOs

Info

ID:	396933
PubChem CID:	135029480
Reduced:	N2O3H16C18 (1)
Stoich.:	A2B3C16D18 (1)
Weight, g/mol:	270.055991
ΔH_f, kcal/mol:	-82.03
Dipole, Da:	3.24
IP(EA), eV:	-8.73(-0.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-chloro-2-methyl-N-phenyl-3,1-benzoxazin-4-imine

Drug info:

PubChemData

Smile

COC1=CC2=C(C[C@]3(CC4=CC=CC=C4NC3=O)C(=O)N2)C=C1

DOS

IR

Vibrations