Geometry & MOs

Info

ID:	233721
PubChem CID:	92093077
Reduced:	O2N4C21H22 (1)
Stoich.:	A2B4C21D22 (1)
Weight, g/mol:	348.158626
ΔH_f, kcal/mol:	-2.04
Dipole, Da:	4.53
IP(EA), eV:	-9.65(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-propan-2-yloxy-N-[(2-pyridin-4-ylpyridin-3-yl)methyl]pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)COC1=NC=C(C=C1)C(=O)NCC2=C(N=CC=C2)C3=CC=NC=C3

DOS

IR

Vibrations