Geometry & MOs

Info

ID:	285291
PubChem CID:	104098954
Reduced:	ON4C14H18 (1)
Stoich.:	AB4C14D18 (1)
Weight, g/mol:	210.148061
ΔH_f, kcal/mol:	37.76
Dipole, Da:	5.04
IP(EA), eV:	-8.86(0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-N-[2-(triazol-1-yl)ethyl]oxan-4-amine

Drug info:

PubChemData

Smile

C1COC2=CC=CC=C2C1CNCCN3C=CN=N3

DOS

IR

Vibrations