Geometry & MOs

Info

ID:	123140
PubChem CID:	50834957
Reduced:	O2N5C30H31 (1)
Stoich.:	A2B5C30D31 (1)
Weight, g/mol:	471.263425
ΔH_f, kcal/mol:	11.96
Dipole, Da:	7.61
IP(EA), eV:	-8.25(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-1-methyl-3-[(N-(4-methylbenzoyl)anilino)methyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)N(CC2=NN(C3=C2CN(CC3)C(=O)NC4=CC=CC=C4C)C)C5=CC=CC=C5

DOS

IR

Vibrations