Geometry & MOs

Info

ID:	310999
PubChem CID:	126588755
Reduced:	NOSC19H23 (1)
Stoich.:	ABCD19E23 (1)
Weight, g/mol:	377.06266
ΔH_f, kcal/mol:	-5.78
Dipole, Da:	5.38
IP(EA), eV:	-8.42(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=CC=CC=C2NC(=S)CC)C

DOS

IR

Vibrations