Geometry & MOs

Info

ID:	346375
PubChem CID:	127270879
Reduced:	N3O3C12H19 (1)
Stoich.:	A3B3C12D19 (1)
Weight, g/mol:	393.147075
ΔH_f, kcal/mol:	-141.24
Dipole, Da:	3.82
IP(EA), eV:	-9.32(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-methyl-1H-indazol-7-yl)-(4-morpholin-4-ylsulfonylpiperazin-1-yl)methanone

Drug info:

PubChemData

Smile

CC(C(=O)N(C)C)N1C(=O)C2(CCCC2)NC1=O

DOS

IR

Vibrations