Geometry & MOs

Info

ID:	271806
PubChem CID:	103692894
Reduced:	BrO2N3C15H22 (1)
Stoich.:	AB2C3D15E22 (1)
Weight, g/mol:	330.155512
ΔH_f, kcal/mol:	-13.98
Dipole, Da:	8.9
IP(EA), eV:	-9.14(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-(2,4,6-trifluoroanilino)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)CN1CCC(CC1)NC2=C(C=C(C=C2)[N+](=O)[O-])Br

DOS

IR

Vibrations