Geometry & MOs

Info

ID:	289882
PubChem CID:	104382795
Reduced:	ON4C16H20 (1)
Stoich.:	AB4C16D20 (1)
Weight, g/mol:	311.06332
ΔH_f, kcal/mol:	-2.28
Dipole, Da:	3.91
IP(EA), eV:	-7.88(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-amino-2-bromoanilino)-1-piperidin-1-ylethanone

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)CNC2=C3C=CC=NC3=C(C=C2)N

DOS

IR

Vibrations