Geometry & MOs

Info

ID:	123030
PubChem CID:	50830990
Reduced:	N5O5C26H33 (1)
Stoich.:	A5B5C26D33 (1)
Weight, g/mol:	403.25834
ΔH_f, kcal/mol:	-152.96
Dipole, Da:	4.13
IP(EA), eV:	-8.86(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-methyl-5-(2-methylpropanoyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-3-carbonyl]-N-propan-2-ylpiperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCC2=C(C1)C(=NN2C)C(=O)N3CCC(CC3)C(=O)NCC4=CC5=C(C=C4)OCO5

DOS

IR

Vibrations