Geometry & MOs

Info

ID:	347954
PubChem CID:	127273016
Reduced:	ON7C18H29 (1)
Stoich.:	AB7C18D29 (1)
Weight, g/mol:	384.11609
ΔH_f, kcal/mol:	15.51
Dipole, Da:	2.85
IP(EA), eV:	-8.38(-0.17)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(5-bromo-2-oxopyridin-1-yl)-N-[2-(4-methylpiperazin-1-yl)propyl]propanamide

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)C2=NNC(=C2)C(=O)NCC(C)N3CCN(CC3)C

DOS

IR

Vibrations