Geometry & MOs

Info

ID:	411033
PubChem CID:	135083842
Reduced:	BrO2C9H15 (1)
Stoich.:	AB2C9D15 (1)
Weight, g/mol:	265.0062
ΔH_f, kcal/mol:	-100.24
Dipole, Da:	2.49
IP(EA), eV:	-10.56(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (Z)-3-(2-acetylhydrazinyl)-3-amino-2-bromoprop-2-enoate

Drug info:

PubChemData

Smile

CC(=O)OC(CCCCBr)C=C

DOS

IR

Vibrations