Geometry & MOs

Info

ID:	348466
PubChem CID:	127273577
Reduced:	ON2C6H8 (3)
Stoich.:	AB2C6D8 (3)
Weight, g/mol:	375.190654
ΔH_f, kcal/mol:	-63.84
Dipole, Da:	2.19
IP(EA), eV:	-8.43(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(4-acetylpiperazin-1-yl)-6-methoxypyridin-3-yl]-2-(2-oxopyrrolidin-1-yl)acetamide

Drug info:

PubChemData

Smile

CC1=C(C=NN1C)C(=O)NC2=C(N=C(C=C2)OC)N3CCN(CC3)C(=O)C

DOS

IR

Vibrations