Geometry & MOs

Info

ID:	292758
PubChem CID:	117358234
Reduced:	N2C7H9 (2)
Stoich.:	A2B7C9 (2)
Weight, g/mol:	242.153147
ΔH_f, kcal/mol:	62.44
Dipole, Da:	4.5
IP(EA), eV:	-9.13(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-(triazol-2-yl)phenyl]cyclohexan-1-amine

Drug info:

PubChemData

Smile

C1CNCCC1CC2=CC=C(C=C2)N3C=NC=N3

DOS

IR

Vibrations