Geometry & MOs

Info

ID:	254737
PubChem CID:	103127298
Reduced:	SO2N3C14H21 (1)
Stoich.:	AB2C3D14E21 (1)
Weight, g/mol:	257.189198
ΔH_f, kcal/mol:	-42.53
Dipole, Da:	7.91
IP(EA), eV:	-8.77(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-cyclopropyl-1-(1-methylindazol-3-yl)ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCS(=O)(=O)CCCC(C1=NN(C2=CC=CC=C21)C)N

DOS

IR

Vibrations