Geometry & MOs

Info

ID:	357418
PubChem CID:	127294051
Reduced:	NO2C10H13 (2)
Stoich.:	AB2C10D13 (2)
Weight, g/mol:	393.147075
ΔH_f, kcal/mol:	-161.39
Dipole, Da:	1.89
IP(EA), eV:	-8.43(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-indazol-1-yl-1-(4-morpholin-4-ylsulfonylpiperazin-1-yl)ethanone

Drug info:

PubChemData

Smile

C1CCC(C1)CCNC(=O)C2CCN(C2=O)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations