Geometry & MOs

Info

ID:	145905
PubChem CID:	53609669
Reduced:	ON6C18H24 (1)
Stoich.:	AB6C18D24 (1)
Weight, g/mol:	327.20591
ΔH_f, kcal/mol:	22.87
Dipole, Da:	2.96
IP(EA), eV:	-8.72(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethyl-1-propan-2-ylpyrazol-4-yl)-6-pyrrolidin-1-ylpyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=NN=C2N1CCN(C2)C(=O)C3=CN=C(C=C3)N4CCCC4

DOS

IR

Vibrations