Geometry & MOs

Info

ID:	346362
PubChem CID:	127270866
Reduced:	S2N3O5C14H17 (1)
Stoich.:	A2B3C5D14E17 (1)
Weight, g/mol:	356.184841
ΔH_f, kcal/mol:	-143.01
Dipole, Da:	6.53
IP(EA), eV:	-9.28(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(5-methyl-1H-indazole-7-carbonyl)piperidin-3-yl]-morpholin-4-ylmethanone

Drug info:

PubChemData

Smile

CC1=C(N=CO1)C(=O)NCC2=CC=C(S2)S(=O)(=O)N3CCOCC3

DOS

IR

Vibrations