Geometry & MOs

Info

ID:	361870
PubChem CID:	127304864
Reduced:	SO3N4C18H24 (1)
Stoich.:	AB3C4D18E24 (1)
Weight, g/mol:	359.184506
ΔH_f, kcal/mol:	-84.65
Dipole, Da:	5.25
IP(EA), eV:	-8.94(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[2-(morpholin-4-ylmethyl)piperidine-1-carbonyl]-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

C1CCN(C(C1)CN2CCOCC2)C(=O)CN3C=NC4=C(C3=O)C=CS4

DOS

IR

Vibrations