Geometry & MOs

Info

ID:	405223
PubChem CID:	135073061
Reduced:	O3C19H30 (1)
Stoich.:	A3B19C30 (1)
Weight, g/mol:	346.99238
ΔH_f, kcal/mol:	-160.95
Dipole, Da:	2.26
IP(EA), eV:	-9.07(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-bromo-3-(2-chloro-N-methylanilino)-2-methyl-3-oxopropanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(C/C=C/1\CCCCC1CC=C(C)C)C(=O)C

DOS

IR

Vibrations