Geometry & MOs

Info

ID:	47735
PubChem CID:	10534986
Reduced:	NOC10H11 (1)
Stoich.:	ABC10D11 (1)
Weight, g/mol:	161.095297
ΔH_f, kcal/mol:	3.45
Dipole, Da:	5.28
IP(EA), eV:	-9.1(-0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-5-methylbenzotriazole

Drug info:

PubChemData

Smile

CC(C#N)C1=CC=CC=C1OC

DOS

IR

Vibrations