Geometry & MOs

Info

ID:	151272
PubChem CID:	53790972
Reduced:	O4C14H17 (2)
Stoich.:	A4B14C17 (2)
Weight, g/mol:	413.079678
ΔH_f, kcal/mol:	-329.42
Dipole, Da:	3.93
IP(EA), eV:	-9.33(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl N-[2,3-dichloro-6-[2-(cyclopropanecarbonyl)-3-ethoxyprop-2-enoyl]phenyl]-N-methylcarbamate

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C1=CC=CC=C1)C(C2=CC=CC=C2)C(C(=O)OCC)C(=O)OCC)C(=O)OCC

DOS

IR

Vibrations