Geometry & MOs

Info

ID:	128144
PubChem CID:	51032518
Reduced:	NSO3H15C16 (1)
Stoich.:	ABC3D15E16 (1)
Weight, g/mol:	233.095297
ΔH_f, kcal/mol:	-69.27
Dipole, Da:	1.87
IP(EA), eV:	-8.66(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-methylindolo[2,1-c][1,2,4]benzotriazine

Drug info:

PubChemData

Smile

CC1=C(C=CO1)SCCCN2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations