Geometry & MOs

Info

ID:	253391
PubChem CID:	103118127
Reduced:	O4N5C12H21 (1)
Stoich.:	A4B5C12D21 (1)
Weight, g/mol:	271.132077
ΔH_f, kcal/mol:	-121.84
Dipole, Da:	3.11
IP(EA), eV:	-9.75(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(pyrazolo[1,5-a]pyridine-3-carbonyl)pyrrolidin-2-yl]propan-2-one

Drug info:

PubChemData

Smile

CC(C(=O)NCCOC)N1C(=C(N=N1)C(=O)OC)CCN

DOS

IR

Vibrations