Geometry & MOs

Info

ID:	317981
PubChem CID:	126648187
Reduced:	NC27H33 (1)
Stoich.:	AB27C33 (1)
Weight, g/mol:	169.048741
ΔH_f, kcal/mol:	159.65
Dipole, Da:	3.93
IP(EA), eV:	-8.69(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

oxazine-2,6-dicarboxamide

Drug info:

PubChemData

Smile

CC/C=C\C(=C/C(=C)C1(CC2=CC=CC=C2C1)CC)\C(=C\3/C#CNC3CC)\C

DOS

IR

Vibrations