Geometry & MOs

Info

ID:	253270
PubChem CID:	103117315
Reduced:	N4O4C11H18 (1)
Stoich.:	A4B4C11D18 (1)
Weight, g/mol:	301.099731
ΔH_f, kcal/mol:	-154.77
Dipole, Da:	7.42
IP(EA), eV:	-10.44(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-(1-aminoethyl)-1,3-thiazol-2-yl]-1-methylindazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCC1=C(N=NN1C)C(=O)O

DOS

IR

Vibrations