Geometry & MOs

Info

ID:	233685
PubChem CID:	92092850
Reduced:	OSN4H14C19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	349.142641
ΔH_f, kcal/mol:	82.63
Dipole, Da:	1.32
IP(EA), eV:	-9.35(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-methoxyphenoxy)-N-[(2-pyridin-4-ylpyridin-3-yl)methyl]acetamide

Drug info:

PubChemData

Smile

C1=CC=C2C(=C1)N=C(S2)C(=O)NCC3=C(N=CC=C3)C4=CC=NC=C4

DOS

IR

Vibrations