Geometry & MOs

Info

ID:	245694
PubChem CID:	103022967
Reduced:	ON4C11H22 (1)
Stoich.:	AB4C11D22 (1)
Weight, g/mol:	184.132411
ΔH_f, kcal/mol:	-30.77
Dipole, Da:	4.12
IP(EA), eV:	-9.54(0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[5-(2-methoxypropan-2-yl)-4-methyl-1,2,4-triazol-3-yl]methanamine

Drug info:

PubChemData

Smile

CCCN1C(=NN=C1CN)CC(C)(C)OC

DOS

IR

Vibrations