Geometry & MOs

Info

ID:	443174
PubChem CID:	135257968
Reduced:	N2O3C17H26 (1)
Stoich.:	A2B3C17D26 (1)
Weight, g/mol:	446.057852
ΔH_f, kcal/mol:	-115.8
Dipole, Da:	4.93
IP(EA), eV:	-8.98(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-N-(4-chlorophenyl)-3-methyl-1-[(1-methylphosphanylimidazol-2-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CC(=NN(CCOCC1=CC=CC=C1)C(=O)OC(C)(C)C)C

DOS

IR

Vibrations