Geometry & MOs

Info

ID:	142609
PubChem CID:	53066374
Reduced:	S2N3O4C17H19 (1)
Stoich.:	A2B3C4D17E19 (1)
Weight, g/mol:	349.21139
ΔH_f, kcal/mol:	-113.44
Dipole, Da:	4.27
IP(EA), eV:	-8.57(-1.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butan-2-yl-1-methyl-3-(morpholine-4-carbonyl)-6,7-dihydro-4H-pyrazolo[4,3-c]pyridine-5-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC=C(S2)S(=O)(=O)N3CCCC3

DOS

IR

Vibrations