Geometry & MOs

Info

ID:	138736
PubChem CID:	52417617
Reduced:	O3N5H21C22 (1)
Stoich.:	A3B5C21D22 (1)
Weight, g/mol:	406.200491
ΔH_f, kcal/mol:	-32.53
Dipole, Da:	4.94
IP(EA), eV:	-8.66(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(6-methyl-4-oxo-2-pyridin-4-yl-1H-pyrimidin-5-yl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C(=O)N=C(N1)C2=CC=NC=C2)CC(=O)NC3=CC4=C(C=C3)OC(=N4)C(C)C

DOS

IR

Vibrations