Geometry & MOs

Info

ID:	142612
PubChem CID:	53066987
Reduced:	ClO2N5H20C21 (1)
Stoich.:	AB2C5D20E21 (1)
Weight, g/mol:	403.200825
ΔH_f, kcal/mol:	-5.03
Dipole, Da:	5.94
IP(EA), eV:	-8.81(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-N-(2,3-dimethylphenyl)-1-methyl-3-N-phenyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3,5-dicarboxamide

Drug info:

PubChemData

Smile

CN1C2=C(CN(CC2)C(=O)NC3=CC=CC=C3Cl)C(=N1)C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations