Geometry & MOs

Info

ID:	283243
PubChem CID:	103967036
Reduced:	ClNO3C15H20 (1)
Stoich.:	ABC3D15E20 (1)
Weight, g/mol:	273.220498
ΔH_f, kcal/mol:	-140.85
Dipole, Da:	5.72
IP(EA), eV:	-8.9(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,3,5,5-tetramethylcyclohexyl)-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)(CNC2=C(C=C(C=C2)Cl)C(=O)O)CO

DOS

IR

Vibrations