Geometry & MOs

Info

ID:	423216
PubChem CID:	135119129
Reduced:	SO3N4C16H26 (1)
Stoich.:	AB3C4D16E26 (1)
Weight, g/mol:	352.133554
ΔH_f, kcal/mol:	-124.12
Dipole, Da:	2.56
IP(EA), eV:	-8.95(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(5-fluoro-1H-indol-2-yl)methyl-methylamino]methyl]-9-hydroxypyrido[1,2-a]pyrimidin-4-one

Drug info:

PubChemData

Smile

CCNC(=O)C1=CN=C(C=C1)NCCC2CCCCN2S(=O)(=O)C

DOS

IR

Vibrations