Geometry & MOs

Info

ID:	311064
PubChem CID:	126589049
Reduced:	ClNO2C20H24 (1)
Stoich.:	ABC2D20E24 (1)
Weight, g/mol:	391.07831
ΔH_f, kcal/mol:	-76.41
Dipole, Da:	6.97
IP(EA), eV:	-9.01(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC(=C(C=C1)OCC2=C(C=CC=C2CC(=O)NC)CC)Cl

DOS

IR

Vibrations