Geometry & MOs

Info

ID:	370384
PubChem CID:	127338413
Reduced:	O2N4C21H26 (1)
Stoich.:	A2B4C21D26 (1)
Weight, g/mol:	380.148455
ΔH_f, kcal/mol:	-18.63
Dipole, Da:	1.23
IP(EA), eV:	-8.86(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,4-dihydro-2H-chromen-6-yl)-1,3,5-trimethyl-2,4-dioxopyrido[2,3-d]pyrimidine-7-carboxamide

Drug info:

PubChemData

Smile

C1CCC(CC1)OC2=CC=CC(=C2)C(=O)N3CCN(CC3)C4=NN=CC=C4

DOS

IR

Vibrations