Geometry & MOs

Info

ID:	422458
PubChem CID:	135117871
Reduced:	ON5C22H29 (1)
Stoich.:	AB5C22D29 (1)
Weight, g/mol:	273.15896
ΔH_f, kcal/mol:	11.05
Dipole, Da:	4.04
IP(EA), eV:	-8.42(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-2-[(1-propylpyrazol-4-yl)methylamino]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CN(C)C1=NC=C2CCC3(C2=N1)CCCN(C3)CC(=O)NCC4=CC=CC=C4

DOS

IR

Vibrations