Geometry & MOs

Info

ID:	264687
PubChem CID:	103482170
Reduced:	O2N3C11H19 (1)
Stoich.:	A2B3C11D19 (1)
Weight, g/mol:	196.168797
ΔH_f, kcal/mol:	-66.01
Dipole, Da:	5.32
IP(EA), eV:	-10.14(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-tert-butyltriazol-4-yl)butan-1-amine

Drug info:

PubChemData

Smile

CCCC1=C(N=NN1C(C)(C)C)C(=O)OC

DOS

IR

Vibrations