Geometry & MOs

Info

ID:	311009
PubChem CID:	126588799
Reduced:	NO4C21H27 (1)
Stoich.:	AB4C21D27 (1)
Weight, g/mol:	411.02368
ΔH_f, kcal/mol:	-148.78
Dipole, Da:	3.35
IP(EA), eV:	-8.52(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[2-[(2-bromo-4-ethyl-5-methylphenoxy)methyl]-3-chlorophenyl]carbamate

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2OCC)NC(=O)OC)CC

DOS

IR

Vibrations