Geometry & MOs

Info

ID:	289382
PubChem CID:	104348529
Reduced:	ON4C15H24 (1)
Stoich.:	AB4C15D24 (1)
Weight, g/mol:	353.11028
ΔH_f, kcal/mol:	-33.93
Dipole, Da:	1.98
IP(EA), eV:	-8.83(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-amino-1-(2-bromophenyl)butyl]pyrrolidin-3-yl]acetamide

Drug info:

PubChemData

Smile

CC(C(C1=CC=CC=N1)N2CCC(CC2)NC(=O)C)N

DOS

IR

Vibrations