Geometry & MOs

Info

ID:	353379
PubChem CID:	127284755
Reduced:	SN2O4C19H24 (1)
Stoich.:	AB2C4D19E24 (1)
Weight, g/mol:	390.136176
ΔH_f, kcal/mol:	-168.84
Dipole, Da:	8.44
IP(EA), eV:	-8.7(-1.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2,4-dioxo-N-(oxolan-2-ylmethyl)-N-(thiolan-3-yl)pyrido[2,3-d]pyrimidine-6-carboxamide

Drug info:

PubChemData

Smile

C1CC(OC1)CN(C2CCSC2)C(=O)C3=CC4=C(CCCC4=O)NC3=O

DOS

IR

Vibrations