Geometry & MOs

Info

ID:	198579
PubChem CID:	79120776
Reduced:	O2N5C12H21 (1)
Stoich.:	A2B5C12D21 (1)
Weight, g/mol:	273.145282
ΔH_f, kcal/mol:	-45.28
Dipole, Da:	5.51
IP(EA), eV:	-9.45(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-methyl-4-N-[6-(trifluoromethyl)pyridin-2-yl]cyclohexane-1,4-diamine

Drug info:

PubChemData

Smile

CC1=NN=C(O1)NC(=O)CN(C)C2CCC(CC2)N

DOS

IR

Vibrations