Geometry & MOs

Info

ID:	363169
PubChem CID:	127310204
Reduced:	SN2O2C8H11 (2)
Stoich.:	AB2C2D8E11 (2)
Weight, g/mol:	325.153875
ΔH_f, kcal/mol:	-93.08
Dipole, Da:	7.66
IP(EA), eV:	-9.12(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1H-indazol-7-yl-[2-[(4-methylpyrazol-1-yl)methyl]morpholin-4-yl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)C(C)NS(=O)(=O)C3=CC=CS3

DOS

IR

Vibrations