Geometry & MOs

Info

ID:	252630
PubChem CID:	103112804
Reduced:	N3O3C15H25 (1)
Stoich.:	A3B3C15D25 (1)
Weight, g/mol:	283.189592
ΔH_f, kcal/mol:	-127.13
Dipole, Da:	4.71
IP(EA), eV:	-10.08(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 1-(3-methoxy-3-methylbutyl)-5-methyltriazole-4-carboxylate

Drug info:

PubChemData

Smile

CC1=C(N=NN1CC2CCC(O2)(C)C)C(=O)OC(C)(C)C

DOS

IR

Vibrations