Geometry & MOs

Info

ID:	247510
PubChem CID:	103071981
Reduced:	FON2C15H19 (1)
Stoich.:	ABC2D15E19 (1)
Weight, g/mol:	216.101111
ΔH_f, kcal/mol:	-65.51
Dipole, Da:	2.3
IP(EA), eV:	-8.83(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-(aminomethyl)prop-2-enyl]-1,2,3-benzotriazin-4-one

Drug info:

PubChemData

Smile

CCNCC(=C)CN1C(=O)CCC2=C1C=CC(=C2)F

DOS

IR

Vibrations