Geometry & MOs

Info

ID:	201451
PubChem CID:	79541000
Reduced:	ClNOC18H24 (1)
Stoich.:	ABCD18E24 (1)
Weight, g/mol:	290.247047
ΔH_f, kcal/mol:	-52.8
Dipole, Da:	3.34
IP(EA), eV:	-8.76(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3,5-trimethyl-N-(2-piperidin-2-ylcyclohexyl)pyrazol-4-amine

Drug info:

PubChemData

Smile

C1CCC(=O)C(C1)C2CCCCN2CC3=CC=CC=C3Cl

DOS

IR

Vibrations