Geometry & MOs

Info

ID:	399841
PubChem CID:	135043116
Reduced:	OC6H9 (2)
Stoich.:	AB6C9 (2)
Weight, g/mol:	348.06847
ΔH_f, kcal/mol:	-102.09
Dipole, Da:	2.11
IP(EA), eV:	-9.91(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[(1R,2S)-2-bromo-1-(2,5-dioxopyrrolidin-1-yl)butyl]carbamate

Drug info:

PubChemData

Smile

C1CCC(C1)C(=O)OC2CCCC=C2

DOS

IR

Vibrations