Geometry & MOs

Info

ID:	59127
PubChem CID:	24771118
Reduced:	N2O3C15H20 (1)
Stoich.:	A2B3C15D20 (1)
Weight, g/mol:	422.141262
ΔH_f, kcal/mol:	-89.68
Dipole, Da:	5.25
IP(EA), eV:	-8.62(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[dimethyl-(1-naphthalen-1-ylsulfonylindazol-7-yl)azaniumyl]propanimidate

Drug info:

PubChemData

Smile

CCN1CCN(CC1)/C=C/C(=O)C2=CC(=C(C=C2)O)O

DOS

IR

Vibrations