Geometry & MOs

Info

ID:	217506
PubChem CID:	85087916
Reduced:	ClO4N5C15H20 (1)
Stoich.:	AB4C5D15E20 (1)
Weight, g/mol:	369.92383
ΔH_f, kcal/mol:	-175.12
Dipole, Da:	5.01
IP(EA), eV:	-9.6(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(2-bromopropanoyloxy)cyclopent-2-en-1-yl] 2-bromopropanoate

Drug info:

PubChemData

Smile

C1CN(C(=O)C1NC(=O)NCCC(=O)O)C2=CC=C(C=C2)C(=N)N.Cl

DOS

IR

Vibrations