Geometry & MOs

Info

ID:	345661
PubChem CID:	127269961
Reduced:	ON4C18H22 (1)
Stoich.:	AB4C18D22 (1)
Weight, g/mol:	277.165349
ΔH_f, kcal/mol:	-0.76
Dipole, Da:	6.21
IP(EA), eV:	-9.32(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cycloheptyl-[3-(trifluoromethyl)piperidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1=NN=C2N1C=C(C=C2)C(=O)NC3C4CC5CC(C4)CC3C5

DOS

IR

Vibrations