Geometry & MOs

Info

ID:	333504
PubChem CID:	127252056
Reduced:	O2N6C23H26 (1)
Stoich.:	A2B6C23D26 (1)
Weight, g/mol:	380.184841
ΔH_f, kcal/mol:	21.67
Dipole, Da:	6.75
IP(EA), eV:	-8.55(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

7-[1-[(4-methoxyphenyl)methyl]pyrrolidin-3-yl]-1,3-dimethylpyrido[2,3-d]pyrimidine-2,4-dione

Drug info:

PubChemData

Smile

CC1=NN2C(=C1)N=CC(=C2C3CN(CCO3)CC4=CC5=C(C=C4)NC=C5)CNC(=O)C

DOS

IR

Vibrations