Geometry & MOs

Info

ID:	255530
PubChem CID:	103132752
Reduced:	N3C16H27 (1)
Stoich.:	A3B16C27 (1)
Weight, g/mol:	277.251798
ΔH_f, kcal/mol:	25.88
Dipole, Da:	3.74
IP(EA), eV:	-8.73(0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(CCC(C(C1)C2=NN(C=C2)C)CNC3CC3)C

DOS

IR

Vibrations