Geometry & MOs

Info

ID:	203741
PubChem CID:	79863277
Reduced:	N3C12H19 (1)
Stoich.:	A3B12C19 (1)
Weight, g/mol:	267.140533
ΔH_f, kcal/mol:	9.54
Dipole, Da:	3.15
IP(EA), eV:	-8.32(1.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(ethylamino)-3,3-dimethylcyclopentyl]sulfanyl-1H-pyrimidin-6-one

Drug info:

PubChemData

Smile

CC1(CCC2=C1N=C3N2CC(CC3)N)C

DOS

IR

Vibrations