Geometry & MOs

Info

ID:	438199
PubChem CID:	135227892
Reduced:	N2C15H20 (1)
Stoich.:	A2B15C20 (1)
Weight, g/mol:	212.106196
ΔH_f, kcal/mol:	47.0
Dipole, Da:	2.62
IP(EA), eV:	-8.34(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-(3,5-dimethyltriazol-4-yl)-3H-indole

Drug info:

PubChemData

Smile

CC(=C/C=C\C=C(/C)\C(C1=CC=CC=N1)N)C

DOS

IR

Vibrations