Geometry & MOs

Info

ID:	207234
PubChem CID:	80364070
Reduced:	BrN3C12H20 (1)
Stoich.:	AB3C12D20 (1)
Weight, g/mol:	255.150225
ΔH_f, kcal/mol:	6.16
Dipole, Da:	2.06
IP(EA), eV:	-9.12(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-chloro-2-cyclopentyl-5-(2,2-dimethylpropyl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1Br)N)C2CCCC2

DOS

IR

Vibrations