Geometry & MOs

Info

ID:	204646
PubChem CID:	79993200
Reduced:	ON4C15H20 (1)
Stoich.:	AB4C15D20 (1)
Weight, g/mol:	276.147393
ΔH_f, kcal/mol:	39.79
Dipole, Da:	1.88
IP(EA), eV:	-9.3(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-amino-5-methylpiperidin-1-yl)-(2,3-dihydro-1,4-benzodioxin-3-yl)methanone

Drug info:

PubChemData

Smile

CC1CC(CN(C1)CC2=NC(=NO2)C3=CC=CC=C3)N

DOS

IR

Vibrations