Geometry & MOs

Info

ID:	414010
PubChem CID:	135086963
Reduced:	N2O2C9H10 (2)
Stoich.:	A2B2C9D10 (2)
Weight, g/mol:	350.060425
ΔH_f, kcal/mol:	-70.05
Dipole, Da:	5.54
IP(EA), eV:	-9.01(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-6-piperazin-1-ylsulfonyl-9H-pyrido[2,3-b]indole

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C=C(C2=CC=CC=C21)/C=C(\CN=[N+]=[N-])/C(=O)OC

DOS

IR

Vibrations