Geometry & MOs

Info

ID:	353628
PubChem CID:	127285205
Reduced:	SN2O3C16H28 (1)
Stoich.:	AB2C3D16E28 (1)
Weight, g/mol:	379.189592
ΔH_f, kcal/mol:	-170.4
Dipole, Da:	3.79
IP(EA), eV:	-9.07(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-(4-benzyl-3,3-dimethylpiperazine-1-carbonyl)-4H-1,4-benzoxazin-3-one

Drug info:

PubChemData

Smile

CC(=O)N1CCC(CC1)CNC(=O)CSCC2CCCCO2

DOS

IR

Vibrations