Geometry & MOs

Info

ID:	8622
PubChem CID:	79626
Reduced:	ON4C11H14 (1)
Stoich.:	AB4C11D14 (1)
Weight, g/mol:	218.116761
ΔH_f, kcal/mol:	42.5
Dipole, Da:	4.04
IP(EA), eV:	-9.24(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(benzotriazol-1-ylmethyl)morpholine

Drug info:

PubChemData

Smile

C1COCCN1CN2C3=CC=CC=C3N=N2

DOS

IR

Vibrations