Geometry & MOs

Info

ID:	214276
PubChem CID:	84974887
Reduced:	SO3N4C19H22 (1)
Stoich.:	AB3C4D19E22 (1)
Weight, g/mol:	364.05349
ΔH_f, kcal/mol:	-45.76
Dipole, Da:	9.08
IP(EA), eV:	-7.86(-1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(7-bromo-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]piperidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CC=C(C=C1)N(C)C)NC2=NS(=O)(=O)C3=CC=CC=C32

DOS

IR

Vibrations