Geometry & MOs

Info

ID:	332609
PubChem CID:	127250895
Reduced:	OSN5C25H29 (1)
Stoich.:	ABC5D25E29 (1)
Weight, g/mol:	443.235497
ΔH_f, kcal/mol:	21.59
Dipole, Da:	8.52
IP(EA), eV:	-8.78(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C2CCCN(C2=NC(=N1)C3CCN(C3)C(=O)CC4=CSC(=N4)C)CC5=CC=CC=C5

DOS

IR

Vibrations