Geometry & MOs

Info

ID:	303121
PubChem CID:	124489236
Reduced:	NOC7H14 (2)
Stoich.:	ABC7D14 (2)
Weight, g/mol:	296.05243
ΔH_f, kcal/mol:	-139.08
Dipole, Da:	2.66
IP(EA), eV:	-8.77(1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-bromophenyl)-[(3R)-3-(dimethylamino)pyrrolidin-1-yl]methanone

Drug info:

PubChemData

Smile

CC(C)[C@H](CN1CCCC1)NC(=O)OC(C)(C)C

DOS

IR

Vibrations