Geometry & MOs

Info

ID:	333351
PubChem CID:	127251903
Reduced:	SO2N6C17H28 (1)
Stoich.:	AB2C6D17E28 (1)
Weight, g/mol:	410.21001
ΔH_f, kcal/mol:	-58.4
Dipole, Da:	3.67
IP(EA), eV:	-9.05(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[7-acetyl-4-(methylamino)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-2-yl]-N,N-diethylpyrrolidine-1-sulfonamide

Drug info:

PubChemData

Smile

CNC1=NC(=NC2=C1CCN(C2)S(=O)(=O)N3CCCCC3)C4CCNC4

DOS

IR

Vibrations