Geometry & MOs

Info

ID:	255521
PubChem CID:	103132684
Reduced:	N3C16H29 (1)
Stoich.:	A3B16C29 (1)
Weight, g/mol:	277.251798
ΔH_f, kcal/mol:	-0.17
Dipole, Da:	1.98
IP(EA), eV:	-8.75(0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-ethyl-2-(1-methylpyrazol-3-yl)cyclohexyl]methyl]-2-methylpropan-2-amine

Drug info:

PubChemData

Smile

CCCNCC1CCC(CC1C2=NN(C=C2)C)CC

DOS

IR

Vibrations