Geometry & MOs

Info

ID:	346341
PubChem CID:	127270845
Reduced:	SO3N4C20H22 (1)
Stoich.:	AB3C4D20E22 (1)
Weight, g/mol:	356.221226
ΔH_f, kcal/mol:	-50.56
Dipole, Da:	5.17
IP(EA), eV:	-8.91(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC(=CC4=C3NN=C4)C

DOS

IR

Vibrations