Geometry & MOs

Info

ID:	175264
PubChem CID:	75876208
Reduced:	O3N4C18H30 (1)
Stoich.:	A3B4C18D30 (1)
Weight, g/mol:	300.144948
ΔH_f, kcal/mol:	-63.68
Dipole, Da:	9.5
IP(EA), eV:	-8.88(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-N-[4-(trifluoromethyl)phenyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(CC(C)C)CNC(=O)NC1=C(C=CC(=C1)[N+](=O)[O-])C

DOS

IR

Vibrations