Geometry & MOs

Info

ID:	403321
PubChem CID:	135059733
Reduced:	N2O2H16C17 (1)
Stoich.:	A2B2C16D17 (1)
Weight, g/mol:	356.038627
ΔH_f, kcal/mol:	-17.06
Dipole, Da:	3.82
IP(EA), eV:	-8.63(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-chloro-9-(4-methylphenyl)sulfonylpyrido[3,4-b]indole

Drug info:

PubChemData

Smile

CCOC(=O)/C=C/C1=CC2=C(N=C1)N(C3=CC=CC=C32)C

DOS

IR

Vibrations