Geometry & MOs

Info

ID:	303161
PubChem CID:	124489289
Reduced:	ON2C15H22 (1)
Stoich.:	AB2C15D22 (1)
Weight, g/mol:	310.06808
ΔH_f, kcal/mol:	-38.59
Dipole, Da:	3.15
IP(EA), eV:	-9.13(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-bromophenyl)-1-[(3R)-3-(methylaminomethyl)pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(=O)N2CC[C@@H](C2)CNC)C

DOS

IR

Vibrations