Geometry & MOs

Info

ID:	262775
PubChem CID:	103316441
Reduced:	N3C11H19 (1)
Stoich.:	A3B11C19 (1)
Weight, g/mol:	339.13101
ΔH_f, kcal/mol:	19.76
Dipole, Da:	3.68
IP(EA), eV:	-8.3(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-bromo-7-cyclohexyl-2-(2-methylpropyl)-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

Drug info:

PubChemData

Smile

CC1CCN=C2N1NC(=C2)CC(C)C

DOS

IR

Vibrations