Geometry & MOs

Info

ID:	27785
PubChem CID:	823540
Reduced:	NO3C14H17 (1)
Stoich.:	AB3C14D17 (1)
Weight, g/mol:	200.081044
ΔH_f, kcal/mol:	-111.12
Dipole, Da:	5.23
IP(EA), eV:	-9.44(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-[1,2,4]triazino[6,5-b]indol-3-ylhydrazine

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)C(=O)N2CCCCC2

DOS

IR

Vibrations