Geometry & MOs

Info

ID:	353316
PubChem CID:	127284645
Reduced:	SO4N5C14H25 (1)
Stoich.:	AB4C5D14E25 (1)
Weight, g/mol:	302.174276
ΔH_f, kcal/mol:	-147.94
Dipole, Da:	12.41
IP(EA), eV:	-8.27(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-methyl-N-[2-(3-methylmorpholin-4-yl)ethyl]-1H-indazole-7-carboxamide

Drug info:

PubChemData

Smile

CC1COCCN1CCNC(=O)CNS(=O)(=O)C2=CN(C(=N2)C)C

DOS

IR

Vibrations