Geometry & MOs

Info

ID:	280081
PubChem CID:	103846723
Reduced:	ON2C8H15 (2)
Stoich.:	AB2C8D15 (2)
Weight, g/mol:	297.216475
ΔH_f, kcal/mol:	-107.71
Dipole, Da:	4.05
IP(EA), eV:	-8.75(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[(3-methyltriazol-4-yl)methylamino]ethyl]-N-propylcarbamate

Drug info:

PubChemData

Smile

CCCN(CCNCC1=C(NN=C1C)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations