Geometry & MOs

Info

ID:	285279
PubChem CID:	104098926
Reduced:	N7C8H13 (1)
Stoich.:	A7B8C13 (1)
Weight, g/mol:	222.184447
ΔH_f, kcal/mol:	118.86
Dipole, Da:	7.46
IP(EA), eV:	-9.68(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,4-dimethyl-N-[2-(triazol-1-yl)ethyl]cyclohexan-1-amine

Drug info:

PubChemData

Smile

CN1C=C(N=N1)CNCCN2C=CN=N2

DOS

IR

Vibrations