Geometry & MOs

Info

ID:	333257
PubChem CID:	127251806
Reduced:	SO3N6C18H30 (1)
Stoich.:	AB3C6D18E30 (1)
Weight, g/mol:	410.21001
ΔH_f, kcal/mol:	-111.42
Dipole, Da:	4.51
IP(EA), eV:	-9.2(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-acetylpyrrolidin-3-yl)-N,N-diethyl-4-(methylamino)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-sulfonamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)N1CCC(C1)C2=NC3=C(CN(CC3)C(=O)C)C(=N2)NC

DOS

IR

Vibrations