Geometry & MOs

Info

ID:	142610
PubChem CID:	53066963
Reduced:	O3N5C17H27 (1)
Stoich.:	A3B5C17D27 (1)
Weight, g/mol:	403.200825
ΔH_f, kcal/mol:	-108.48
Dipole, Da:	4.42
IP(EA), eV:	-9.31(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)NC(=O)N1CCC2=C(C1)C(=NN2C)C(=O)N3CCOCC3

DOS

IR

Vibrations