Geometry & MOs

Info

ID:	365773
PubChem CID:	127318498
Reduced:	N3O3C23H33 (1)
Stoich.:	A3B3C23D33 (1)
Weight, g/mol:	313.142641
ΔH_f, kcal/mol:	-126.67
Dipole, Da:	4.33
IP(EA), eV:	-8.98(0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-2,4-dioxo-N-(1-phenylcyclopentyl)pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

C1CCC(C1)(C2=CC=CC=C2)NC(=O)CCN3CCN(CC3)C(=O)C4CCCO4

DOS

IR

Vibrations