Geometry & MOs

Info

ID:	269596
PubChem CID:	103618116
Reduced:	BrFN2O2C16H22 (1)
Stoich.:	ABC2D2E16F22 (1)
Weight, g/mol:	304.215078
ΔH_f, kcal/mol:	-144.74
Dipole, Da:	4.05
IP(EA), eV:	-8.7(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 4-(3,4-dimethylanilino)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CCC(CC1)NC2=C(C=C(C=C2)Br)F

DOS

IR

Vibrations