Geometry & MOs

Info

ID:	247488
PubChem CID:	103071793
Reduced:	BrN2O2H11C12 (1)
Stoich.:	AB2C2D11E12 (1)
Weight, g/mol:	196.121178
ΔH_f, kcal/mol:	-14.28
Dipole, Da:	4.86
IP(EA), eV:	-9.42(-1.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[2-[(cyclopropylamino)methyl]prop-2-enyl]-1,3-oxazolidin-2-one

Drug info:

PubChemData

Smile

C=C(CN)CN1C2=C(C=CC(=C2)Br)C(=O)C1=O

DOS

IR

Vibrations