Geometry & MOs

Info

ID:	206485
PubChem CID:	80258324
Reduced:	N2C17H28 (1)
Stoich.:	A2B17C28 (1)
Weight, g/mol:	207.173548
ΔH_f, kcal/mol:	-8.38
Dipole, Da:	4.4
IP(EA), eV:	-8.86(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(1-ethylcyclopentyl)-5-propyl-1H-1,2,4-triazole

Drug info:

PubChemData

Smile

CCCNC(C(C)C1=CC=NC=C1)C2(CCCC2)C

DOS

IR

Vibrations