Geometry & MOs

Info

ID:	414944
PubChem CID:	135087924
Reduced:	ON4C18H24 (1)
Stoich.:	AB4C18D24 (1)
Weight, g/mol:	274.088832
ΔH_f, kcal/mol:	6.2
Dipole, Da:	2.89
IP(EA), eV:	-9.08(0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2,1,3-benzoxadiazol-5-yl)-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]methanamine

Drug info:

PubChemData

Smile

CN(C)CCN(CC1=CN=CN1)C(=O)C2CC3=CC=CC=C3C2

DOS

IR

Vibrations