Geometry & MOs

Info

ID:	414011
PubChem CID:	135086964
Reduced:	ClSO2N4C15H15 (1)
Stoich.:	ABC2D4E15F15 (1)
Weight, g/mol:	394.086639
ΔH_f, kcal/mol:	-13.56
Dipole, Da:	5.19
IP(EA), eV:	-9.12(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[(4-chloro-9H-pyrido[2,3-b]indol-6-yl)sulfonyl]piperazin-1-yl]ethanol

Drug info:

PubChemData

Smile

C1CN(CCN1)S(=O)(=O)C2=CC3=C(C=C2)NC4=NC=CC(=C34)Cl

DOS

IR

Vibrations